data_2jrh_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 2jrh _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.4 t0 . . . . . 0 N--CA 1.465 0.309 0 CA-C-O 120.842 0.353 . . . . 0.0 111.055 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.9 t -94.91 116.37 36.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.269 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -87.25 115.42 24.63 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.735 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.7 mt -114.25 126.47 71.77 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.933 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.9 mtpt -100.65 115.45 30.24 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.873 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -101.58 138.93 37.93 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.025 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -122.44 128.17 50.55 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.962 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 25.2 t-80 -142.86 112.02 6.6 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.57 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 59.21 34.06 22.95 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.114 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.73 -31.01 6.82 Favored Glycine 0 CA--C 1.524 0.602 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.815 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -65.41 142.99 58.0 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.873 0.368 . . . . 0.0 111.151 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -119.71 143.55 47.71 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.362 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.92 134.89 30.65 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.948 179.617 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 22.1 mt -105.77 118.17 52.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.88 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.8 mt -128.33 129.9 69.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.179 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.46 147.44 23.54 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.2 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -130.38 138.8 50.56 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.287 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.5 p -94.98 119.83 34.16 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.948 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.5 mtt180 -68.61 150.32 97.7 Favored Pre-proline 0 N--CA 1.464 0.254 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.893 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -72.72 144.43 80.77 Favored 'Cis proline' 0 C--N 1.35 0.623 0 C-N-CA 123.776 -1.343 . . . . 0.0 112.425 0.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.3 p -113.2 123.61 69.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.027 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.7 mptt -101.01 137.52 39.27 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.048 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -54.78 -40.36 69.35 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.036 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -63.19 -45.31 92.34 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.973 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -64.37 -44.41 91.47 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.131 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.3 t -62.46 -46.8 95.53 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.663 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.05 -46.07 85.97 Favored 'General case' 0 CA--C 1.528 0.111 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.038 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.05 -42.07 79.87 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 120.6 0.238 . . . . 0.0 111.246 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 38.9 tttp -71.1 -49.8 40.47 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.25 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 39.6 t -64.82 -41.53 92.42 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.765 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 54.9 m -58.81 -39.43 81.14 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.905 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.4 m -71.91 -36.81 70.09 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 121.369 -0.132 . . . . 0.0 111.258 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 42.3 t -61.21 -55.18 26.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 N-CA-C 111.541 0.2 . . . . 0.0 111.541 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -89.96 -19.68 24.21 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -178.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 105.07 179.24 24.24 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.301 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -139.92 154.17 70.35 Favored Pre-proline 0 N--CA 1.464 0.271 0 O-C-N 122.819 -0.224 . . . . 0.0 110.914 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -85.84 148.73 44.04 Favored 'Cis proline' 0 C--N 1.351 0.684 0 C-N-CA 123.607 -1.414 . . . . 0.0 113.207 0.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 20.0 mt -138.74 158.59 43.95 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.03 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -113.3 140.35 48.07 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.002 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.9 mt -102.75 107.08 17.84 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.196 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -104.03 125.65 50.55 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.128 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -114.53 130.3 56.74 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.408 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 9.4 ptp -128.62 122.16 30.28 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.853 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -79.91 -59.7 2.63 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.462 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -175.03 -55.75 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.463 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -106.8 -26.32 11.32 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.551 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.3 mt -123.36 145.68 48.55 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.715 0.293 . . . . 0.0 111.248 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 56.1 p -120.82 132.78 55.2 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.811 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mp -126.94 132.53 69.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.972 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.33 118.98 25.2 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.323 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 26.8 mt -65.89 105.73 1.38 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.945 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.0 mttp -110.88 -35.82 5.85 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.222 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -136.47 171.91 13.79 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.105 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -58.2 -29.94 66.07 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.119 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.426 ' HA ' ' OD2' ' A' ' 60' ' ' ASP . 1.2 m-20 -56.26 -43.5 78.79 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.116 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -66.89 -32.22 73.34 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.799 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 33.1 tp -64.86 -45.44 86.08 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.726 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.426 ' OD2' ' HA ' ' A' ' 57' ' ' ASP . 2.5 p30 -70.56 -31.85 69.03 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.577 0.227 . . . . 0.0 110.975 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -38.02 89.06 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.713 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.43 -42.98 86.92 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.2 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.3 mm -66.34 -41.69 89.36 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.156 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -55.15 -45.46 75.67 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.192 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.6 mt -66.57 -39.27 83.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.813 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 20.0 tp -64.56 -43.67 93.2 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.877 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -57.16 -42.68 81.55 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.069 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.71 -31.95 72.96 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.073 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 27.5 t -79.03 146.18 33.46 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.128 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.63 -18.75 62.18 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.541 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 60.3 p -93.57 38.2 1.06 Allowed 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.756 0.312 . . . . 0.0 111.554 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.35 84.71 4.51 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.639 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp -138.93 -58.99 0.6 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.929 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.1 p -112.99 168.22 9.87 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.041 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.5 mp -122.62 138.81 54.48 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.038 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 7.4 ttp180 -97.31 87.57 4.19 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.982 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.1 mt -117.68 118.2 57.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.691 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.3 tt -108.52 128.65 54.99 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.178 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.5 pp -113.76 136.61 52.67 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.846 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -135.6 148.19 48.95 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.163 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.6 p -72.65 147.39 45.81 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.391 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 . . . . . 0 CA--C 1.535 0.369 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -179.556 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.6 t0 . . . . . 0 C--O 1.235 0.3 0 CA-C-O 120.677 0.275 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 22.2 t -96.08 123.19 48.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.888 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.7 mtt180 -87.29 114.81 24.23 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.951 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 23.7 mt -105.9 118.51 53.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.827 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -103.65 114.7 29.16 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.363 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.494 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 0.9 OUTLIER -117.6 145.53 44.25 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.921 -179.774 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -119.21 139.88 51.12 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.615 -179.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . 0.44 ' CD2' HD13 ' A' ' 79' ' ' LEU . 24.5 t-80 -141.02 114.65 8.89 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.364 179.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 51.3 m-20 57.63 33.47 23.29 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.657 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.14 -47.0 1.14 Allowed Glycine 0 C--N 1.336 0.545 0 C-N-CA 120.863 -0.684 . . . . 0.0 113.36 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.24 145.39 51.39 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.815 0.34 . . . . 0.0 110.997 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 ptp180 -124.1 147.66 47.74 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.622 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.494 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -131.02 137.33 49.14 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.749 179.641 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 19.1 mt -117.41 126.32 74.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.908 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 28.0 mt -138.98 131.6 37.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.957 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.37 145.73 24.72 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.179 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -131.13 125.36 32.89 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.116 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.7 t -71.39 126.68 30.29 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.007 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 25.6 mtt85 -71.6 144.91 89.3 Favored Pre-proline 0 CA--C 1.53 0.192 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.031 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -77.38 123.12 9.2 Favored 'Cis proline' 0 C--N 1.349 0.581 0 C-N-CA 123.193 -1.586 . . . . 0.0 112.612 -0.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.3 p -72.27 145.4 12.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.058 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.5 mmmt -111.38 132.28 54.55 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.259 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -57.46 -43.29 83.88 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.895 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -59.19 -43.56 92.21 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.167 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.7 -44.57 85.74 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.346 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 23.7 t -65.39 -47.97 84.9 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.738 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.67 -46.14 86.92 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.345 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 67.2 t60 -56.38 -41.01 75.51 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.535 0.207 . . . . 0.0 111.443 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.4 tttp -71.05 -49.79 40.97 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.341 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 46.5 t -66.4 -43.01 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.602 -179.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 53.4 m -59.05 -39.24 81.42 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.314 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.5 m -72.2 -36.69 69.26 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.399 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.0 t -62.34 -51.6 70.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -95.59 -18.09 20.85 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -178.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 105.93 -177.51 22.58 Favored Glycine 0 CA--C 1.523 0.557 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.599 -179.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.433 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 7.6 pm0 -134.08 155.43 80.07 Favored Pre-proline 0 N--CA 1.463 0.219 0 O-C-N 122.776 -0.249 . . . . 0.0 111.098 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.433 ' HA ' ' HB2' ' A' ' 38' ' ' GLN . 83.4 Cg_endo -90.0 145.1 17.82 Favored 'Cis proline' 0 C--N 1.348 0.508 0 C-N-CA 123.651 -1.396 . . . . 0.0 113.101 0.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 23.2 mt -138.49 139.87 38.96 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.831 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -112.4 140.28 47.27 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.092 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mt -87.45 113.97 23.63 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.036 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -106.04 117.54 34.28 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.014 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -107.17 122.84 47.31 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 120.783 0.325 . . . . 0.0 110.697 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 28.2 mtp -110.62 128.17 55.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.431 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -71.3 -56.42 6.05 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.711 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -178.86 -52.99 0.01 OUTLIER 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.329 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -104.73 -29.73 10.38 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.53 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -119.68 160.35 22.69 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.876 0.37 . . . . 0.0 111.522 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.5 m -104.64 132.33 51.02 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.988 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 25.1 mm -116.02 133.45 62.44 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.916 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.0 mt -104.4 125.15 50.35 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.89 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -119.59 106.13 11.88 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.398 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -107.77 -34.43 6.97 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.137 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -98.23 166.11 11.56 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.626 0.25 . . . . 0.0 110.825 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.06 -35.64 80.93 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.04 179.428 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -52.84 -47.05 68.02 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.141 179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.4 -31.66 72.56 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.177 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.0 tp -72.69 -39.03 67.34 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.68 -0.236 . . . . 0.0 110.552 179.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.86 -43.5 98.71 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.268 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -66.63 -38.84 87.77 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.818 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.31 -45.0 93.38 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.562 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 14.1 mt -66.37 -41.13 88.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.894 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -55.08 -44.96 75.33 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.039 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.3 mt -64.82 -43.11 96.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.733 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 9.2 tp -62.01 -47.3 85.39 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.129 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.97 -37.49 87.84 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.246 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -72.61 -35.27 67.82 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.069 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.0 t -76.39 128.26 34.47 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.39 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 27.9 p -75.09 -38.43 61.22 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.826 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.74 -47.16 32.74 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.171 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -78.79 91.76 4.76 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.113 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.9 mtpt -97.0 -45.81 6.44 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.184 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.8 p -91.0 151.2 21.15 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.902 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.98 124.15 35.87 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.01 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -93.68 88.9 6.0 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.878 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 31.1 mt -111.93 117.66 55.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.583 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.9 tp -102.06 123.69 46.37 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.852 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.44 HD13 ' CD2' ' A' ' 10' ' ' HIS . 2.3 pp -112.07 130.99 55.7 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.778 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.5 142.69 50.01 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.988 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.51 143.79 27.55 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.859 179.299 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.305 0 CA-C-N 115.971 -0.558 . . . . 0.0 112.1 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 p30 . . . . . 0 N--CA 1.464 0.243 0 CA-C-O 121.162 0.506 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 23.1 t -90.42 116.38 31.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.926 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.6 mtt180 -90.06 121.79 32.46 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.744 0.307 . . . . 0.0 111.049 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.422 HG21 ' CZ ' ' A' ' 8' ' ' PHE . 2.6 mt -115.57 130.06 70.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.989 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.4 tttm -95.45 126.89 41.06 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.699 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.422 ' CZ ' HG21 ' A' ' 6' ' ' ILE . 81.5 m-85 -117.1 136.25 53.14 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.282 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -121.96 127.54 50.47 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.074 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.6 t-80 -131.13 112.57 12.98 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.686 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 55.67 34.76 23.92 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.523 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 98.69 -35.42 4.64 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.686 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.79 136.58 57.07 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.716 0.293 . . . . 0.0 110.817 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.13 145.29 41.19 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.621 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.63 130.2 13.97 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.087 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.9 mp -102.49 125.8 56.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.808 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.6 mt -130.38 134.29 62.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.219 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.27 138.8 31.22 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.248 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 -130.78 117.4 19.32 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.76 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.1 m -76.85 143.34 39.77 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.728 0.299 . . . . 0.0 111.188 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.5 mtm105 -96.05 154.98 38.75 Favored Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.125 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -73.12 142.44 74.76 Favored 'Cis proline' 0 C--N 1.349 0.597 0 C-N-CA 123.57 -1.429 . . . . 0.0 112.335 -0.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.5 p -128.41 147.58 32.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.944 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.97 143.96 44.73 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.007 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -56.52 -36.95 69.8 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.285 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.87 -44.93 91.19 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.9 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -69.63 -44.3 70.9 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.007 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.52 -46.16 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.866 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -58.65 -42.19 87.81 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.286 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -57.42 -46.1 83.88 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.742 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.5 tttp -70.18 -48.78 55.77 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.943 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 44.4 t -58.81 -42.37 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-N 116.76 -0.2 . . . . 0.0 111.318 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 86.4 m -64.19 -39.58 94.3 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.056 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 60.1 m -72.47 -42.72 64.63 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.449 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.5 t -61.98 -51.37 73.34 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -87.81 -20.95 25.39 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 103.49 -175.72 23.76 Favored Glycine 0 C--N 1.337 0.631 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.676 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -144.32 155.46 57.73 Favored Pre-proline 0 N--CA 1.465 0.316 0 CA-C-O 120.528 0.204 . . . . 0.0 111.01 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -84.09 137.63 28.16 Favored 'Cis proline' 0 C--N 1.35 0.641 0 C-N-CA 123.546 -1.439 . . . . 0.0 113.205 0.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.8 mt -137.18 130.41 31.02 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.744 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -105.09 139.86 39.13 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.729 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 64.7 mt -92.16 108.53 20.01 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.808 0.337 . . . . 0.0 110.94 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -109.36 117.74 34.83 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.495 -179.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -96.1 124.52 40.14 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.392 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 53.4 mtp -117.56 125.87 51.57 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.542 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.1 t30 -87.48 -52.61 5.26 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.777 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -173.58 -62.55 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.369 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -108.82 -25.55 10.73 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.565 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -111.93 149.33 32.07 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.823 0.344 . . . . 0.0 111.147 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.6 m -113.22 131.15 56.01 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.978 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.8 mt -121.63 133.99 66.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.909 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.9 mp -105.34 124.65 49.9 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.709 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.2 mp -91.81 92.61 8.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.721 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 42.8 mttm -111.17 30.44 6.9 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.134 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -175.97 167.39 3.02 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.912 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -63.13 -38.95 93.22 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.311 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.36 -44.45 80.14 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.338 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -64.78 -46.16 83.27 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.001 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 33.0 tp -61.26 -41.25 96.58 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.664 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -61.17 -43.09 99.43 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.575 179.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.3 mttm -65.31 -38.67 90.92 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.011 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.54 -41.35 98.82 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.015 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 18.8 mt -64.9 -43.84 96.25 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.081 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.662 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.67 -45.06 73.83 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.206 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 41.5 mt -68.36 -45.24 82.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.353 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -65.92 -48.05 72.7 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.041 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -60.2 -41.77 93.67 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.296 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -74.15 -31.65 62.81 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.66 -179.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 76.9 p -80.91 112.07 17.96 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.6 0.238 . . . . 0.0 110.663 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 53.0 m -71.43 -30.32 65.91 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.062 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.16 -34.09 71.68 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.587 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 5.9 ttm -111.61 140.97 45.79 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.649 0.261 . . . . 0.0 111.053 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.4 mttt -115.46 -44.36 2.98 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.118 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 67.5 m -100.46 170.98 8.03 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.745 179.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -91.87 120.6 32.71 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.786 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.0 mmt85 -91.76 73.98 5.78 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.537 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 36.0 mt -111.34 124.71 68.37 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.833 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.9 tp -102.08 119.63 39.11 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.863 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.0 pp -106.86 125.07 50.53 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.888 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -116.8 162.75 17.21 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.282 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 40.6 t -88.21 137.4 32.36 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.993 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 10.8 tp60 . . . . . 0 CA--C 1.533 0.291 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.687 179.373 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.412 0 CA-C-O 120.967 0.413 . . . . 0.0 111.205 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.8 t -86.06 110.48 19.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.982 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.26 108.8 19.11 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.688 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 19.5 mt -109.54 128.45 65.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.837 0.351 . . . . 0.0 111.44 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -101.35 123.4 45.38 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.828 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -115.03 139.88 49.51 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.041 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -124.26 125.44 44.39 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.959 0.409 . . . . 0.0 111.102 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.4 t-80 -138.25 124.02 19.89 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.513 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 57.64 32.07 21.31 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.29 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.36 -41.38 2.59 Favored Glycine 0 C--N 1.337 0.607 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.816 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -68.87 152.25 45.54 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 120.778 0.323 . . . . 0.0 111.332 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.15 151.43 35.67 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.186 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.3 mtt85 -128.5 127.51 42.56 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.736 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mt -98.18 117.02 42.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.747 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 25.5 mm -131.2 133.42 62.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-O 120.826 0.346 . . . . 0.0 111.068 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -107.41 136.88 46.47 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.047 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.425 ' CZ ' ' HA ' ' A' ' 28' ' ' VAL . 8.5 m-85 -121.24 126.93 50.81 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.5 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -82.33 150.13 27.37 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.98 179.356 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.8 mtt-85 -87.63 143.11 33.35 Favored Pre-proline 0 N--CA 1.463 0.192 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.87 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -78.92 166.54 79.06 Favored 'Cis proline' 0 C--N 1.352 0.753 0 C-N-CA 123.661 -1.391 . . . . 0.0 112.766 0.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.5 p -146.85 139.49 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.099 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -114.65 159.79 20.07 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.681 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -55.53 -40.62 72.06 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.666 -0.243 . . . . 0.0 110.958 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.12 -43.43 91.94 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.009 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -63.02 -44.64 95.37 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.987 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.425 ' HA ' ' CZ ' ' A' ' 19' ' ' PHE . 41.1 t -68.0 -47.7 77.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.907 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -64.01 -44.91 91.16 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.172 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -56.4 -43.45 79.33 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.421 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.35 -49.33 56.62 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.096 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 47.6 t -63.13 -44.84 99.64 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.511 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 90.4 m -58.42 -39.37 79.58 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.982 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 28.5 m -72.27 -40.8 67.37 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 121.186 -0.206 . . . . 0.0 111.303 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.9 t -56.83 -51.85 62.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 120.558 0.218 . . . . 0.0 111.553 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -90.37 -27.4 19.38 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 102.44 -160.12 17.5 Favored Glycine 0 C--N 1.336 0.536 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.577 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -144.88 158.46 52.71 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 120.446 0.165 . . . . 0.0 110.868 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -87.5 131.77 12.07 Favored 'Cis proline' 0 C--N 1.346 0.427 0 C-N-CA 123.649 -1.396 . . . . 0.0 113.055 0.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 17.9 mt -136.71 147.71 46.92 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.089 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -114.55 130.17 56.73 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.991 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mt -87.8 110.07 20.21 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.873 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.429 ' CD2' ' HB3' ' A' ' 50' ' ' SER . 0.1 OUTLIER -115.41 119.46 36.32 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.495 -179.67 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.408 ' CD1' ' HB1' ' A' ' 62' ' ' ALA . 12.7 t80 -98.59 130.44 45.13 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.867 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -101.95 131.02 48.59 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.642 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -77.99 -40.12 40.17 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.786 0.327 . . . . 0.0 110.797 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -174.48 -54.51 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.202 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.8 -41.08 3.85 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.353 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -100.36 165.94 11.21 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.995 0.426 . . . . 0.0 111.388 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.429 ' HB3' ' CD2' ' A' ' 43' ' ' HIS . 2.5 m -121.29 122.25 39.49 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.763 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.15 131.78 65.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.184 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.11 135.07 34.55 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.709 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.42 86.64 3.66 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.456 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -99.55 24.57 8.04 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.672 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -166.08 160.05 16.01 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.588 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.8 -40.82 89.64 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.73 0.3 . . . . 0.0 110.394 179.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -61.94 -46.25 90.11 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.984 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -60.67 -44.33 96.6 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.882 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.7 tp -63.01 -42.96 99.97 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.111 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -69.45 -34.84 74.99 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.277 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.0 ttpt -62.39 -37.01 84.09 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.863 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.408 ' HB1' ' CD1' ' A' ' 44' ' ' TYR . . . -64.77 -37.86 89.05 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.991 179.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 33.2 mm -63.75 -43.92 98.14 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.19 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -53.9 -36.48 62.76 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.053 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.8 mt -66.63 -40.11 85.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.819 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 26.2 tp -62.39 -40.06 95.26 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.118 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.19 -34.36 68.43 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.3 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.0 -34.51 76.64 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.898 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.4 t -81.61 97.93 8.1 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.048 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.3 p -63.69 -33.76 76.36 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.404 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.8 p -71.16 -49.31 45.25 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.246 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.9 ttm -67.89 147.21 52.81 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.075 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.28 -48.34 0.59 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.31 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.41 171.11 15.57 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.706 0.289 . . . . 0.0 110.842 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -102.36 118.25 36.48 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.744 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -92.16 84.04 5.19 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.777 0.322 . . . . 0.0 110.93 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.9 mt -109.29 128.56 65.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.004 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.36 123.8 50.96 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.32 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.8 pp -112.97 131.48 55.74 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.696 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 mp -121.09 151.22 40.1 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.241 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.5 t -98.14 147.41 24.6 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.119 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.261 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.651 179.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 . . . . . 0 C--O 1.234 0.243 0 CA-C-O 120.99 0.424 . . . . 0.0 111.205 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 32.2 t -75.77 129.63 36.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.973 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -87.81 112.06 22.05 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.78 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 19.8 mt -99.11 125.9 52.49 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.02 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.0 mttt -99.33 117.67 34.28 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.8 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.423 ' CD1' HD11 ' A' ' 17' ' ' ILE . 80.0 m-85 -107.37 145.72 32.52 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.036 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -125.9 126.1 43.87 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.13 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.0 t-160 -141.27 116.94 10.31 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.567 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 16.0 m120 57.21 34.92 25.52 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.236 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.94 -38.34 3.17 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.864 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -65.3 150.81 47.62 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.759 0.314 . . . . 0.0 111.291 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.58 157.14 37.88 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.357 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.2 142.28 24.92 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.056 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.3 mp -114.59 119.56 61.87 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.941 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.423 HD11 ' CD1' ' A' ' 8' ' ' PHE . 3.1 mt -127.12 130.79 71.16 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.038 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.11 143.42 26.38 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.434 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -137.6 117.08 12.86 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.903 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.9 p -72.69 143.21 48.16 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.083 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.82 153.92 37.65 Favored Pre-proline 0 C--O 1.232 0.171 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.305 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -74.53 140.57 68.02 Favored 'Cis proline' 0 C--N 1.351 0.706 0 C-N-CA 123.54 -1.442 . . . . 0.0 112.528 0.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.9 p -127.01 143.67 39.71 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.048 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.64 142.48 27.3 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.062 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 50.3 t80 -59.58 -36.99 77.31 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.209 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.56 -45.0 89.89 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.995 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -63.05 -44.58 95.48 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.157 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 24.9 t -67.05 -46.7 84.0 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.935 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -45.2 89.81 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.169 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -56.78 -46.77 81.29 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.761 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.06 -49.83 63.81 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.3 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 47.4 t -58.48 -43.29 86.52 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.335 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 95.4 m -62.8 -39.45 94.3 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.02 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 39.0 m -72.08 -42.86 65.68 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 121.254 -0.178 . . . . 0.0 111.425 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.7 t -56.57 -51.91 59.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-O 120.54 0.21 . . . . 0.0 111.533 -179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -88.32 -28.21 21.18 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.73 -159.95 18.17 Favored Glycine 0 C--N 1.334 0.442 0 C-N-CA 121.0 -0.619 . . . . 0.0 112.347 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.76 156.15 55.98 Favored Pre-proline 0 N--CA 1.464 0.244 0 CA-C-O 120.437 0.16 . . . . 0.0 110.787 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -88.07 131.35 10.97 Favored 'Cis proline' 0 C--N 1.35 0.639 0 C-N-CA 123.559 -1.434 . . . . 0.0 112.939 0.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.4 mt -138.34 130.55 28.7 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.138 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -101.64 135.2 43.56 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.019 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.3 mt -91.27 104.16 16.74 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.781 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -106.48 129.71 54.4 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.27 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -106.1 119.32 38.91 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.582 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 5.3 mtt -131.76 140.01 49.11 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.933 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 -99.35 -45.98 5.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.775 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -172.95 -64.11 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.486 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -108.82 -30.83 7.95 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.464 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.3 mt -93.73 132.58 37.95 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.716 0.293 . . . . 0.0 111.227 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 94.8 p -112.1 122.58 48.15 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.798 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.0 mp -127.5 132.72 69.01 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.032 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.9 tt -102.96 131.17 50.11 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.515 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 12.1 mt -74.52 84.75 2.03 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.085 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.2 tptt -77.86 -37.61 47.89 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.977 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -145.23 -179.24 6.51 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.139 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -57.47 -35.09 69.71 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.842 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.24 -46.18 79.69 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.963 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -60.45 -41.61 94.44 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.711 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.7 tp -63.42 -43.45 97.45 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.125 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.46 -41.11 98.52 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.254 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.04 -35.75 81.27 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.684 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.96 -38.34 90.71 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.166 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.6 mm -63.89 -42.43 95.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.083 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -56.71 -39.46 73.91 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.035 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 47.6 mt -68.36 -40.48 82.47 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.046 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 92.8 mt -61.05 -46.9 88.82 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.061 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.91 -31.34 70.86 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.176 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.7 mmt180 -66.94 -28.02 67.94 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.257 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.8 t -59.75 148.49 34.08 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.872 0.367 . . . . 0.0 111.502 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.07 -35.52 71.93 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.234 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -158.36 93.25 1.2 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.996 0.427 . . . . 0.0 111.754 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -167.22 107.83 0.61 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.053 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -99.28 -31.89 11.47 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.341 179.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.87 165.03 25.7 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.744 0.307 . . . . 0.0 111.372 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -110.27 131.66 54.86 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.281 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.18 78.95 8.74 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.936 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.7 mm -104.01 113.58 41.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.607 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.4 tt -110.77 117.15 32.66 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.861 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.5 pp -112.33 130.61 55.9 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.874 0.368 . . . . 0.0 110.967 179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -121.64 156.94 31.93 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.204 -179.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 6.1 t -83.01 147.65 28.04 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.779 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 33.2 tp60 . . . . . 0 CA--C 1.532 0.286 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.915 179.738 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 . . . . . 0 N--CA 1.465 0.314 0 CA-C-O 120.981 0.419 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 25.4 t -86.18 145.04 8.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.424 -179.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -93.49 106.41 18.38 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.017 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.2 mt -104.69 125.96 59.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.071 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -103.93 129.47 51.48 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.596 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -111.83 131.55 55.27 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.859 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.426 ' HG3' ' HG3' ' A' ' 14' ' ' ARG . 24.7 tt0 -119.39 130.01 55.09 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.819 0.342 . . . . 0.0 111.116 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.7 t-160 -141.07 121.0 13.59 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.694 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 61.07 26.2 16.16 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.604 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.36 -46.96 1.14 Allowed Glycine 0 C--N 1.338 0.644 0 C-N-CA 120.912 -0.661 . . . . 0.0 113.415 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -66.02 139.58 58.22 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.925 0.362 . . . . 0.0 111.275 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.426 ' HG3' ' HG3' ' A' ' 9' ' ' GLU . 2.6 mtt85 -108.91 155.25 21.05 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.419 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.1 149.22 50.0 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.926 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 34.3 mt -115.32 117.68 56.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.078 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 21.2 mm -131.57 136.49 57.17 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.257 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.53 141.32 28.74 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.992 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -128.91 117.1 20.43 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.937 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 37.8 t -86.29 140.84 29.71 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.89 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -84.79 157.53 60.46 Favored Pre-proline 0 CA--C 1.531 0.25 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.025 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.75 157.48 99.52 Favored 'Cis proline' 0 C--N 1.35 0.628 0 C-N-CA 123.486 -1.464 . . . . 0.0 112.77 0.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.7 p -139.25 139.25 39.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.196 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.3 mptt -119.47 154.61 33.5 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.719 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -54.35 -45.13 72.65 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.85 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.43 -41.94 99.09 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.16 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -62.58 -44.24 96.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.987 -179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.4 t -67.7 -43.25 86.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.793 179.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.81 -45.37 86.2 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.442 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.74 -42.75 99.38 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.315 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -69.92 -49.72 49.24 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.267 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 47.6 t -61.55 -40.91 88.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 CA-C-N 116.663 -0.244 . . . . 0.0 111.476 -179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 22.3 m -58.62 -41.26 85.49 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.088 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 34.8 m -72.56 -37.39 68.24 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 111.524 0.194 . . . . 0.0 111.524 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.1 t -61.23 -52.7 58.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 N-CA-C 111.876 0.325 . . . . 0.0 111.876 -179.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -98.16 -15.85 19.75 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -178.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.14 -156.9 21.88 Favored Glycine 0 C--N 1.334 0.457 0 C-N-CA 120.598 -0.81 . . . . 0.0 112.349 -179.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -144.74 158.48 53.14 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.456 0.169 . . . . 0.0 111.056 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -89.61 132.48 9.74 Favored 'Cis proline' 0 C--N 1.349 0.595 0 C-N-CA 123.771 -1.345 . . . . 0.0 112.889 0.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 29.2 mt -138.53 135.45 35.08 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.012 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -114.73 139.52 49.62 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.049 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.7 mt -80.81 108.89 14.86 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.945 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.8 m80 -114.0 120.42 40.58 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.116 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.454 ' CE2' HG12 ' A' ' 77' ' ' ILE . 0.5 OUTLIER -88.88 129.53 35.58 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.854 179.721 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 17.6 mtp -125.8 117.8 24.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.53 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 20.0 m-20 -79.18 -54.25 6.17 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.794 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -172.9 -61.34 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.353 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -107.46 -24.76 11.7 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.434 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.59 149.84 29.82 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.865 0.364 . . . . 0.0 111.389 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.53 122.36 45.46 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.001 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.4 HG22 HD11 ' A' ' 51' ' ' ILE . 28.7 mm -114.37 131.36 66.62 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.785 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.7 tt -94.78 130.52 41.29 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.783 0.325 . . . . 0.0 111.024 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -81.79 95.32 7.25 Favored 'General case' 0 CA--C 1.527 0.086 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.379 179.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -84.71 -36.03 22.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.122 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.1 m-20 -144.67 -179.73 6.76 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.936 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 13.3 tp60 -58.41 -33.41 69.63 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.8 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -53.16 -41.65 65.38 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.201 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -64.53 -40.96 96.57 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.769 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 11.0 mt -65.52 -42.0 92.53 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.008 179.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.93 -39.81 90.83 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.91 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -68.24 -39.48 82.27 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.642 178.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.65 -43.67 88.68 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.558 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.2 mt -62.81 -40.97 90.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 116.701 -0.227 . . . . 0.0 110.771 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -52.86 -34.97 56.8 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.24 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 30.6 mm -66.65 -45.37 88.54 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.07 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.0 mt -66.77 -45.14 79.46 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.988 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.12 -40.16 94.96 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.004 179.744 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -63.21 -35.23 79.63 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.129 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.8 t -70.48 122.14 19.1 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.899 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.74 -36.01 75.73 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.222 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 32.3 p -70.64 -81.06 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.907 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.3 tmm? 64.04 160.01 0.1 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.064 0.459 . . . . 0.0 111.696 179.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.34 -59.72 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.367 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 m -155.52 174.77 14.79 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.574 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.4 mp -91.95 131.66 37.1 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.413 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -95.7 74.78 3.18 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.136 0.493 . . . . 0.0 111.199 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.454 HG12 ' CE2' ' A' ' 44' ' ' TYR . 25.6 mt -103.92 129.22 56.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.819 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.9 tt -113.38 118.25 34.03 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.103 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.3 pp -104.19 131.55 51.37 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.706 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.4 pp -118.8 159.72 23.21 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.067 0.46 . . . . 0.0 111.334 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -90.72 147.6 23.15 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.77 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 . . . . . 0 N--CA 1.465 0.313 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 179.867 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.233 0 CA-C-O 120.91 0.386 . . . . 0.0 110.302 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 36.2 t -79.86 125.14 38.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.868 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.3 mtm105 -94.36 106.34 18.32 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.699 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.7 mp -101.92 134.43 42.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.997 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.8 mttm -100.34 118.09 35.89 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.714 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.449 ' CD1' HD11 ' A' ' 17' ' ' ILE . 93.2 m-85 -107.39 131.88 53.78 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.146 -179.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -126.58 131.94 51.41 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.212 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 9.0 t-160 -139.49 121.08 15.2 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.529 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.0 m-20 57.25 31.64 20.41 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.221 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.11 -30.22 7.87 Favored Glycine 0 CA--C 1.524 0.609 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.937 -179.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -65.61 140.57 58.53 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.761 0.315 . . . . 0.0 111.187 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -103.69 154.97 18.95 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.32 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.2 tpp180 -151.76 144.23 24.15 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.069 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.3 mt -113.66 127.64 70.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.001 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.449 HD11 ' CD1' ' A' ' 8' ' ' PHE . 20.1 mt -138.39 125.61 27.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-O 120.784 0.326 . . . . 0.0 111.29 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -112.49 131.07 55.77 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.042 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -128.07 126.8 41.93 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.75 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.3 t -68.3 128.11 35.38 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.946 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -71.35 150.83 94.21 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.062 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -74.62 125.76 11.62 Favored 'Cis proline' 0 C--N 1.35 0.645 0 C-N-CA 123.517 -1.451 . . . . 0.0 112.308 0.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.5 p -73.58 131.91 34.19 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.04 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.98 127.14 42.66 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.154 -179.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -53.95 -43.72 70.1 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.076 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -60.97 -38.85 87.38 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.087 179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -69.17 -44.27 72.58 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.124 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.0 t -63.76 -47.24 91.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.019 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -63.91 -36.75 84.96 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.186 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -56.68 -45.22 81.87 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.583 0.23 . . . . 0.0 111.061 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.89 -48.84 62.36 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.325 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 50.0 t -62.63 -40.58 88.92 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.538 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 79.9 m -61.01 -47.26 87.27 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.896 -0.138 . . . . 0.0 111.269 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.0 m -72.88 -44.52 61.21 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 70.1 t -67.1 -44.8 87.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.449 ' HB2' HD12 ' A' ' 40' ' ' LEU . 15.9 m-85 -100.28 7.06 44.65 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.09 172.7 23.59 Favored Glycine 0 C--N 1.339 0.704 0 C-N-CA 120.503 -0.856 . . . . 0.0 112.88 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -135.04 154.65 79.23 Favored Pre-proline 0 C--O 1.234 0.242 0 O-C-N 122.853 -0.204 . . . . 0.0 110.98 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -88.02 153.61 38.33 Favored 'Cis proline' 0 C--N 1.35 0.609 0 C-N-CA 123.567 -1.43 . . . . 0.0 113.338 0.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.449 HD12 ' HB2' ' A' ' 36' ' ' PHE . 15.7 mt -124.6 160.4 28.51 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.08 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -111.46 126.3 54.8 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.661 179.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.2 mp -90.23 96.24 10.57 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.818 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -115.22 122.98 47.66 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.284 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -105.79 129.4 53.99 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.691 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -131.27 120.73 23.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.731 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -85.02 -68.42 0.73 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.851 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -149.08 -74.61 0.17 Allowed 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.393 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -110.1 4.66 21.4 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.433 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -130.12 140.03 50.84 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.792 0.329 . . . . 0.0 111.277 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -115.23 128.3 56.06 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.712 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 18.8 mt -128.39 134.26 65.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.958 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 39.8 mt -93.85 132.81 37.9 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.941 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -122.95 88.04 2.86 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.011 0.434 . . . . 0.0 111.26 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.92 -32.51 14.54 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.969 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -100.87 166.64 10.74 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.982 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -31.98 73.44 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.027 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -56.82 -50.11 73.35 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.063 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -63.09 -45.02 94.1 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.822 0.344 . . . . 0.0 110.802 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.3 tp -58.59 -45.88 88.16 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.022 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.79 -42.18 97.79 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.012 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.8 tmtt? -62.34 -38.63 90.21 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.729 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.42 -39.88 94.75 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.54 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 12.7 mt -63.57 -43.73 98.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-O 120.606 0.241 . . . . 0.0 110.881 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -56.17 -39.5 72.43 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.11 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.4 mt -64.03 -45.03 97.83 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.907 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.5 tt -61.85 -47.35 85.45 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.673 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -58.6 -40.31 82.89 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.076 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -33.14 74.02 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.384 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 33.6 t -83.2 119.97 25.22 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.754 0.311 . . . . 0.0 111.208 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.4 p -68.0 -35.37 78.21 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.921 179.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.99 -37.08 67.13 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.402 -179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.89 109.0 15.03 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.711 0.291 . . . . 0.0 111.132 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.77 -31.99 7.24 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.784 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.2 m -122.15 154.35 37.54 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.656 0.265 . . . . 0.0 110.948 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.1 mp -92.74 117.35 29.91 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.174 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.74 86.1 3.99 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.384 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.9 mt -102.26 131.79 49.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.681 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 41.8 tp -102.12 117.25 34.38 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.755 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.4 HD11 HD22 ' A' ' 40' ' ' LEU . 2.7 pp -104.87 126.95 52.48 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.865 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.8 mp -119.2 122.74 42.67 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.849 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.75 142.84 44.3 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.153 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.464 0.26 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.904 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 p30 . . . . . 0 N--CA 1.464 0.271 0 CA-C-O 120.875 0.369 . . . . 0.0 111.403 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.415 ' CG1' HD21 ' A' ' 75' ' ' LEU . 17.6 t -150.09 128.26 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.993 179.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -97.09 116.27 29.0 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.637 0.256 . . . . 0.0 110.963 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 21.7 mt -107.52 118.16 54.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.183 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.471 ' CD ' ' HB3' ' A' ' 74' ' ' SER . 0.0 OUTLIER -95.03 109.59 21.61 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.71 179.786 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.449 ' CD1' HD22 ' A' ' 79' ' ' LEU . 16.2 m-85 -104.28 142.25 34.86 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.154 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -134.47 124.24 25.28 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.886 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . 0.413 ' HB2' HD13 ' A' ' 79' ' ' LEU . 10.9 t-160 -142.28 121.21 12.8 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.699 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 62.1 t30 57.16 34.0 24.18 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.88 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 91.02 -32.23 5.25 Favored Glycine 0 C--N 1.337 0.622 0 C-N-CA 121.047 -0.596 . . . . 0.0 113.075 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.35 136.86 55.47 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.836 0.35 . . . . 0.0 111.247 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -114.19 142.6 46.04 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.946 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.8 mtm-85 -134.11 140.49 46.63 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.172 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.9 mm -114.1 117.44 55.52 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.003 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.1 mt -125.78 137.89 56.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.215 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -110.54 133.94 52.84 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.172 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -125.4 122.83 37.86 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.196 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.88 158.49 19.31 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.042 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.05 154.95 40.58 Favored Pre-proline 0 CA--C 1.531 0.245 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.955 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -76.7 126.6 13.55 Favored 'Cis proline' 0 C--N 1.351 0.71 0 C-N-CA 123.396 -1.502 . . . . 0.0 112.737 -0.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.5 p -90.07 146.82 5.72 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.335 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.5 mtpt -120.82 143.66 48.75 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.098 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 24.3 t80 -54.79 -52.97 60.98 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.077 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.42 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 0.3 OUTLIER -61.1 -34.82 75.55 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.163 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.33 -43.54 77.29 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.139 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 43.5 t -63.18 -47.63 91.44 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.126 0 CA-C-N 116.693 -0.231 . . . . 0.0 111.146 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.42 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 9.3 pt-20 -64.49 -37.9 89.13 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.276 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -49.03 76.55 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.722 -0.217 . . . . 0.0 110.892 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.74 -48.96 64.98 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.278 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 43.0 t -59.17 -41.44 83.73 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 116.678 -0.237 . . . . 0.0 111.358 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 99.4 m -65.01 -41.45 95.32 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.908 -0.133 . . . . 0.0 111.042 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.9 m -72.76 -43.71 62.53 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 121.108 -0.237 . . . . 0.0 111.617 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.5 t -66.47 -49.67 73.41 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 N-CA-C 111.574 0.213 . . . . 0.0 111.574 -179.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -88.71 -10.72 47.41 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -179.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.21 -176.89 40.8 Favored Glycine 0 C--N 1.338 0.65 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.575 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.439 ' HA ' HD13 ' A' ' 40' ' ' LEU . 1.0 OUTLIER -145.19 156.31 54.35 Favored Pre-proline 0 N--CA 1.465 0.285 0 CA-C-O 120.528 0.204 . . . . 0.0 110.83 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -93.25 128.22 5.12 Favored 'Cis proline' 0 C--N 1.351 0.699 0 C-N-CA 123.918 -1.284 . . . . 0.0 112.933 0.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 38' ' ' GLN . 6.3 mp -134.57 139.98 45.78 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.992 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.66 139.47 38.2 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.137 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.06 106.47 18.54 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.213 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -101.65 118.98 38.05 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.251 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.406 ' CD1' HG12 ' A' ' 77' ' ' ILE . 2.2 t80 -88.95 118.5 28.72 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.822 179.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -130.63 116.16 17.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.764 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -80.85 -50.35 9.9 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.791 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.45 -63.7 0.02 OUTLIER 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.61 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.6 mp0 -109.54 -24.12 11.15 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.726 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.7 mp -103.4 138.83 39.6 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.79 0.328 . . . . 0.0 111.317 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 87.2 p -114.32 121.62 44.19 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.87 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.5 mp -124.44 134.28 67.12 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.712 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 14.6 tp -98.96 124.91 44.23 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.771 -0.195 . . . . 0.0 110.705 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.5 mt -65.0 103.42 0.73 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.912 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.1 mtmm -103.1 -31.78 9.99 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.703 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -148.08 173.85 12.52 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.779 0.323 . . . . 0.0 111.465 -179.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -56.94 -29.72 63.4 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.138 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -53.08 -41.74 65.19 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.036 179.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -68.39 -40.67 81.28 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.761 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 36.5 mt -63.52 -40.28 96.62 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.526 179.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.419 ' HA ' ' CD1' ' A' ' 63' ' ' ILE . 1.2 t0 -67.22 -37.62 83.9 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.163 179.627 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.47 -36.69 83.28 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.769 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.84 -37.71 87.86 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.185 179.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.419 ' CD1' ' HA ' ' A' ' 60' ' ' ASP . 11.1 mt -63.84 -44.29 98.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.951 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.03 -39.34 69.02 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.063 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 29.5 mt -66.79 -42.97 90.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.015 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 40.4 mt -67.45 -46.41 73.15 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.139 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -60.98 -38.94 87.76 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.369 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -65.69 -32.68 74.37 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.427 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 33.8 t -109.26 93.59 4.59 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.959 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.8 m -59.48 -27.28 65.98 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.765 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.0 t -57.67 -35.39 70.5 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.542 0.21 . . . . 0.0 111.282 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -117.21 163.17 16.7 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.762 0.315 . . . . 0.0 111.251 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -162.24 36.56 0.12 Allowed 'General case' 0 C--O 1.235 0.342 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.265 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' SER . . . . . 0.471 ' HB3' ' CD ' ' A' ' 7' ' ' LYS . 0.9 OUTLIER -143.18 149.11 37.57 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.708 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.415 HD21 ' CG1' ' A' ' 4' ' ' VAL . 0.1 OUTLIER -111.58 132.92 54.2 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.855 179.78 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.81 119.45 36.43 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.956 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.428 HD13 HG23 ' A' ' 77' ' ' ILE . 16.0 mt -128.45 118.33 47.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.873 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -106.3 122.17 45.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.955 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.449 HD22 ' CD1' ' A' ' 8' ' ' PHE . 3.0 pp -114.36 135.85 53.63 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.691 179.689 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.0 mp -114.3 144.35 43.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.792 -179.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -98.84 136.55 38.7 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.008 0.433 . . . . 0.0 110.999 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.278 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.123 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 . . . . . 0 C--O 1.234 0.25 0 CA-C-O 120.889 0.376 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.2 t -131.34 129.0 62.11 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.966 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.8 mtt-85 -88.5 112.72 23.31 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.952 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 6.2 mt -106.33 128.65 60.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.956 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.5 mtpt -104.04 125.23 50.23 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.586 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.431 ' CE1' HD11 ' A' ' 17' ' ' ILE . 20.6 m-85 -109.21 144.54 37.18 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.213 -179.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -121.77 124.0 43.16 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.294 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 12.1 t-160 -141.2 115.83 9.6 Favored 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.438 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 56.8 m-20 58.21 30.9 20.1 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 120.818 0.342 . . . . 0.0 111.137 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.9 -2.79 87.7 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 121.105 -0.569 . . . . 0.0 113.296 -179.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -85.64 143.08 28.63 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 117.216 0.508 . . . . 0.0 110.886 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.01 137.74 43.41 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.12 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -133.94 133.78 41.8 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.788 179.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.4 mp -114.07 117.29 55.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.073 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.431 HD11 ' CE1' ' A' ' 8' ' ' PHE . 10.9 mt -129.38 131.36 67.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.157 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -102.81 145.41 29.8 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.136 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -138.84 116.9 11.71 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.031 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.4 p -78.98 135.84 37.04 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.031 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.1 mtt180 -74.87 152.81 86.87 Favored Pre-proline 0 CA--C 1.531 0.243 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.844 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -72.79 129.04 16.46 Favored 'Cis proline' 0 C--N 1.35 0.611 0 C-N-CA 123.763 -1.349 . . . . 0.0 112.426 0.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 15.0 p -99.94 118.8 47.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.163 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.0 mmmt -91.32 132.44 36.17 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.979 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -54.44 -41.64 69.64 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.704 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -59.32 -45.32 91.64 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.051 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.69 -44.63 85.59 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.121 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 38.9 t -62.91 -47.94 90.39 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.918 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -60.78 -41.61 95.91 Favored 'General case' 0 N--CA 1.461 0.1 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.936 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -57.23 -48.43 78.85 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.119 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.9 tttt -68.62 -49.5 58.71 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.257 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 45.6 t -58.4 -44.67 89.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 CA-C-N 116.814 -0.176 . . . . 0.0 111.295 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 91.1 m -66.79 -39.38 87.76 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.192 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.4 m -72.15 -43.24 64.94 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.6 t -64.92 -51.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-O 120.463 0.173 . . . . 0.0 111.246 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -83.67 -20.37 33.67 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -179.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.401 ' O ' HD13 ' A' ' 40' ' ' LEU . . . 100.08 -179.77 29.95 Favored Glycine 0 C--N 1.338 0.656 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.521 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -139.55 156.36 71.39 Favored Pre-proline 0 N--CA 1.464 0.26 0 O-C-N 122.73 -0.276 . . . . 0.0 111.175 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -85.75 137.04 21.62 Favored 'Cis proline' 0 C--N 1.35 0.621 0 C-N-CA 123.438 -1.484 . . . . 0.0 112.897 0.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.401 HD13 ' O ' ' A' ' 37' ' ' GLY . 47.4 mt -137.9 130.07 28.96 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.515 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -103.68 138.78 39.84 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.9 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.2 mt -95.62 110.4 22.51 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.786 179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -111.09 126.71 55.12 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.954 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -89.14 126.33 35.42 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.722 179.736 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -131.2 118.55 20.59 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.617 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -83.61 -58.99 2.58 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.675 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -175.31 -52.29 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.544 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -109.37 -30.6 7.89 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.542 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.9 mp -112.41 154.77 25.27 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.788 0.328 . . . . 0.0 111.222 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -121.27 126.78 50.4 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.91 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 28.3 mm -113.75 134.44 56.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.859 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -96.59 126.7 41.95 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.792 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.415 HD13 HD12 ' A' ' 59' ' ' LEU . 0.5 OUTLIER -99.37 87.33 3.59 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 121.045 0.45 . . . . 0.0 110.835 179.939 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.3 mtpp -105.03 -34.2 8.06 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.138 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -103.92 163.49 12.33 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 120.78 0.324 . . . . 0.0 110.973 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.1 tm0? -63.34 -37.95 89.25 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.799 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.55 -38.54 84.82 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.206 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.62 -49.92 75.57 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.04 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.415 HD12 HD13 ' A' ' 53' ' ' LEU . 13.0 tp -63.89 -40.94 97.68 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.93 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.06 -37.62 84.35 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.213 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -62.66 -39.35 93.63 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.665 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.75 -38.27 90.47 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.088 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 25.2 mt -65.49 -41.9 92.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.141 179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.45 -39.59 67.57 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.037 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 45.1 mt -64.7 -38.37 82.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.949 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 15.9 mt -64.17 -45.37 88.73 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.828 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.86 -32.63 69.62 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.302 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.1 mtt-85 -66.09 -31.81 72.9 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.119 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.5 t -104.02 112.07 24.9 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.241 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.71 -33.4 71.57 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.461 179.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.8 p -72.79 -71.08 0.31 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.432 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.74 106.32 6.24 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 120.842 0.353 . . . . 0.0 111.384 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 25.1 pttt -114.74 -35.84 4.71 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.483 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.87 170.3 11.4 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 120.714 0.292 . . . . 0.0 111.526 -179.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.2 mp -114.9 133.5 55.93 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.399 -179.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -102.6 81.45 2.03 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.517 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.5 mt -106.42 129.64 59.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.016 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.2 pp -109.03 132.65 53.91 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.023 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.1 pp -111.15 135.9 50.99 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.634 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.6 mt -112.57 146.9 37.73 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.168 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.5 t -94.57 147.89 22.81 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.811 179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 . . . . . 0 N--CA 1.467 0.376 0 N-CA-C 112.378 0.511 . . . . 0.0 112.378 179.764 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 . . . . . 0 N--CA 1.466 0.37 0 CA-C-O 120.676 0.274 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.3 t -134.37 146.78 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.616 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -93.67 133.08 37.4 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.981 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 29.7 mt -114.76 136.4 51.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.918 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.7 mttt -108.25 122.39 46.84 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.753 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.445 ' CZ ' HG23 ' A' ' 32' ' ' VAL . 74.0 m-85 -116.66 139.89 50.02 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.873 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -119.34 131.37 55.71 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.1 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.6 t-160 -136.01 114.7 11.96 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.658 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 57.72 35.14 25.28 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.218 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 95.23 -35.22 4.38 Favored Glycine 0 C--N 1.337 0.635 0 C-N-CA 120.915 -0.66 . . . . 0.0 113.005 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.39 150.47 48.24 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.611 0.243 . . . . 0.0 111.135 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -118.37 141.01 48.97 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.221 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 91.9 mtt-85 -129.14 147.77 51.02 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.1 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 19.2 mt -115.03 126.45 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.087 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 9.2 tp -140.22 135.31 36.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.278 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -101.85 141.19 35.08 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.14 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -126.52 153.05 45.69 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.119 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 47.5 t -95.31 142.84 27.24 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.19 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -97.12 140.85 22.31 Favored Pre-proline 0 CA--C 1.53 0.208 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.633 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -74.6 143.89 79.24 Favored 'Cis proline' 0 C--N 1.351 0.695 0 C-N-CA 123.78 -1.342 . . . . 0.0 112.676 0.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.0 p -105.99 133.79 49.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.908 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.9 142.71 29.3 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.924 -179.664 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -60.34 -43.7 96.2 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.979 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -60.05 -41.88 93.29 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.951 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.95 -44.48 92.68 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.328 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.4 t -67.28 -47.47 81.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.78 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -57.87 -45.78 85.82 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.161 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -56.87 -47.3 80.75 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.102 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.9 tttt -67.09 -49.57 64.54 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.17 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.445 HG23 ' CZ ' ' A' ' 8' ' ' PHE . 47.9 t -58.26 -44.76 88.76 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.344 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 87.7 m -61.2 -40.42 93.88 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.151 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 20.5 m -72.54 -42.93 64.19 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 111.525 0.194 . . . . 0.0 111.525 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 62.1 t -62.54 -52.23 62.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -87.09 -18.77 29.73 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 98.11 179.66 32.78 Favored Glycine 0 C--N 1.337 0.622 0 C-N-CA 120.65 -0.785 . . . . 0.0 112.612 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.3 pm0 -140.36 154.14 69.38 Favored Pre-proline 0 N--CA 1.465 0.315 0 O-C-N 122.863 -0.198 . . . . 0.0 110.927 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -83.3 143.87 48.6 Favored 'Cis proline' 0 C--N 1.35 0.618 0 C-N-CA 123.525 -1.448 . . . . 0.0 113.033 0.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 17.8 mt -138.52 138.93 38.5 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.155 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -104.83 119.44 39.01 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.987 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.84 113.63 22.14 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.943 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -114.08 119.52 37.41 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.135 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -101.85 129.76 48.15 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.694 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.66 133.33 55.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.785 179.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -83.32 -59.65 2.39 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.521 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -149.97 -65.11 0.21 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.408 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -123.21 10.74 9.35 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.54 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -126.75 164.77 20.6 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.625 0.25 . . . . 0.0 111.114 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -121.06 118.43 29.77 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.888 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 22.3 mt -120.17 133.06 68.12 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.991 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.31 122.75 45.45 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.86 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.52 91.82 6.97 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.722 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.8 -32.17 16.2 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.397 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -116.1 162.33 17.58 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.758 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -62.31 -31.36 71.97 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.991 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -53.45 -46.0 69.72 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.771 0.319 . . . . 0.0 110.815 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.38 -37.36 87.22 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.299 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -61.24 -47.14 87.41 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.482 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -68.39 -32.15 72.02 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.151 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.0 tttm -62.64 -38.44 90.28 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.765 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.76 -36.11 82.62 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.069 179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 36.4 mm -59.36 -47.78 89.38 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.836 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -55.49 -42.61 74.65 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.917 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 9.9 mt -67.73 -43.09 86.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.141 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.959 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 13.9 tp -58.74 -45.57 89.37 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.83 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -65.83 -32.65 74.29 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.18 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.6 mmt180 -64.69 -33.51 76.13 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.32 179.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 42.2 t -103.36 111.25 23.58 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.184 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 51.6 p -62.49 -39.97 95.19 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.968 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 32.8 p -61.14 -34.65 75.34 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.435 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.5 ttp -90.89 92.52 8.81 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.715 0.293 . . . . 0.0 110.99 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -97.86 -34.63 10.78 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.169 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.2 m -92.2 166.71 12.49 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.838 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.8 mt -97.53 120.72 38.42 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.964 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -89.66 84.51 6.32 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.684 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 15.2 mt -117.72 124.14 72.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.126 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.3 tp -111.38 117.37 32.91 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.813 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.3 pp -103.3 136.18 43.56 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.847 0.356 . . . . 0.0 111.158 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.7 mp -119.26 158.13 26.66 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.156 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -88.91 137.1 32.62 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.076 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 48.4 tp60 . . . . . 0 N--CA 1.466 0.361 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.806 179.603 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.467 0.421 0 CA-C-O 120.686 0.279 . . . . 0.0 111.407 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.7 t -140.16 127.38 23.62 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.003 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.1 120.08 28.0 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.917 0.389 . . . . 0.0 111.172 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 30.2 mm -106.27 117.7 52.52 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.055 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.0 mttt -101.87 111.56 23.86 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.541 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.451 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 1.8 p90 -117.0 142.58 46.77 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.179 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -122.39 140.07 53.12 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.444 -179.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.2 t-160 -140.94 113.39 8.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.439 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.2 m120 59.76 31.42 20.81 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.541 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 104.18 -43.95 1.57 Allowed Glycine 0 C--N 1.335 0.505 0 C-N-CA 120.847 -0.692 . . . . 0.0 113.223 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -70.96 135.85 48.14 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.762 0.281 . . . . 0.0 111.119 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -119.24 156.73 29.39 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.787 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.451 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 1.1 tpt180 -141.39 143.74 34.11 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.285 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.4 mt -116.9 118.93 60.44 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.054 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 27.4 mm -129.95 137.58 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-O 120.746 0.308 . . . . 0.0 111.262 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.09 145.95 24.62 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.228 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -133.37 117.88 17.79 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.166 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 65.7 m -72.95 136.13 45.13 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.243 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 44.1 mtm180 -100.45 156.83 34.77 Favored Pre-proline 0 CA--C 1.53 0.182 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.006 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.18 122.28 8.11 Favored 'Cis proline' 0 C--N 1.35 0.654 0 C-N-CA 123.258 -1.559 . . . . 0.0 112.657 0.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.7 p -104.36 153.23 6.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.168 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -104.81 137.02 43.23 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.685 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -54.88 -37.06 65.81 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.67 179.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -58.52 -45.1 89.52 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.002 179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -67.33 -44.66 78.55 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.161 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.0 t -62.34 -47.32 93.59 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.127 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.85 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.27 -44.25 95.48 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.906 179.583 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -56.8 -40.92 76.83 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.098 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.64 -49.47 62.77 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.167 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.5 t -64.79 -41.29 91.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.373 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 96.5 m -60.17 -39.52 86.71 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.158 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 16.5 m -71.89 -29.09 63.97 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 121.238 -0.185 . . . . 0.0 111.344 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 44.8 t -69.37 -53.67 23.87 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-O 120.583 0.23 . . . . 0.0 111.449 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -94.18 -11.22 30.83 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -178.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.92 177.39 28.04 Favored Glycine 0 C--N 1.335 0.504 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.646 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -129.46 153.89 80.68 Favored Pre-proline 0 C--O 1.233 0.227 0 CA-C-O 120.623 0.249 . . . . 0.0 111.18 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -89.12 136.1 12.6 Favored 'Cis proline' 0 C--N 1.349 0.582 0 C-N-CA 123.494 -1.461 . . . . 0.0 112.919 0.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 55.3 mt -138.03 136.14 36.58 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.722 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -115.19 140.55 48.99 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.051 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 mp -81.74 112.31 18.79 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.508 179.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -101.36 129.86 47.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -88.88 124.42 34.19 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-O 120.742 0.306 . . . . 0.0 111.32 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 4.6 tpp -126.23 107.74 10.64 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.771 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.2 m-20 -78.91 -60.81 2.23 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.863 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -154.92 -59.07 0.11 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.573 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.43 11.78 6.38 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.553 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -131.59 152.49 50.75 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.648 0.261 . . . . 0.0 111.428 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 t -120.18 126.64 51.16 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.924 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.4 mt -114.1 134.33 57.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.855 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -93.84 126.78 39.23 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.85 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -100.54 96.77 7.6 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.033 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.4 tttm -93.98 -32.92 13.64 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.277 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.0 m-20 -136.99 173.2 11.95 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.754 0.311 . . . . 0.0 111.14 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -60.25 -29.81 69.02 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.958 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -53.65 -43.94 69.18 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.093 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -66.88 -38.37 86.17 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.645 179.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.44 -45.32 91.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.162 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.14 -41.32 98.16 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.194 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -62.32 -38.82 90.89 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.65 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.6 -41.32 98.34 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.584 179.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.2 mt -63.55 -44.63 98.73 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-O 120.66 0.267 . . . . 0.0 110.762 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.39 -42.3 77.7 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.174 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.1 mt -68.02 -42.41 85.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.087 179.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 10.0 tp -59.62 -46.21 89.67 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.976 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.37 -35.62 70.21 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.24 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.62 -31.74 63.7 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.098 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.7 t -64.76 141.42 58.78 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.439 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.5 t -70.3 -30.73 67.8 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.772 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 47.7 p -92.7 37.11 1.01 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.881 0.372 . . . . 0.0 111.484 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -72.0 140.76 49.24 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.977 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -179.04 -43.3 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.073 179.677 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 64.1 m -147.14 178.06 8.68 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.798 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.7 mp -106.72 119.36 39.12 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.89 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.0 ttp180 -82.56 77.94 9.26 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.995 0.426 . . . . 0.0 110.608 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.4 ' O ' ' HA ' ' A' ' 8' ' ' PHE . 22.1 mt -104.4 118.58 51.89 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.883 -179.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -102.2 127.42 49.14 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.048 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.3 pp -111.15 131.13 55.35 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.046 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 mp -140.87 151.15 44.08 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.873 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.79 132.7 47.9 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.993 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.284 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.288 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.6 t70 . . . . . 0 N--CA 1.464 0.244 0 CA-C-O 120.98 0.419 . . . . 0.0 111.053 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.4 t -81.0 125.02 39.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.016 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.11 115.47 29.09 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.604 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 3.8 mp -110.1 134.05 53.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.059 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.64 114.95 29.08 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.679 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -103.2 127.03 50.64 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.775 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -120.33 124.05 44.61 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.916 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.8 t-160 -139.27 116.23 10.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.547 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.27 31.7 21.38 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.174 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.66 -28.79 9.42 Favored Glycine 0 C--N 1.339 0.695 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.867 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -65.03 137.4 57.68 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.796 0.331 . . . . 0.0 111.098 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -110.23 136.05 50.04 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.014 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.1 mtp180 -130.03 136.49 49.45 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.96 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.5 mp -114.38 117.4 55.46 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.873 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 19.9 mt -131.87 137.06 55.78 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 CA-C-O 120.828 0.347 . . . . 0.0 111.27 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -101.67 132.54 47.31 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.079 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -124.96 126.48 45.54 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.977 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.1 m -72.78 153.89 40.9 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.375 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.5 mtt180 -95.48 146.98 32.27 Favored Pre-proline 0 CA--C 1.53 0.208 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.166 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -78.24 124.08 10.25 Favored 'Cis proline' 0 C--N 1.349 0.569 0 C-N-CA 123.313 -1.536 . . . . 0.0 112.49 -0.052 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.0 p -69.34 126.88 30.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.99 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.1 mmmt -102.18 147.69 26.33 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.029 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -60.42 -40.18 90.09 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.65 179.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -62.23 -44.71 95.94 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.246 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.85 -44.35 96.37 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.189 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.9 t -65.86 -46.92 87.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.479 179.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -63.11 -42.15 99.5 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.266 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -56.2 -43.07 78.15 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.56 0.219 . . . . 0.0 111.471 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -70.38 -49.7 46.36 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.183 179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 38.6 t -62.4 -40.98 90.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.463 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.41 ' CG2' ' HB3' ' A' ' 38' ' ' GLN . 52.4 m -61.8 -43.02 99.68 Favored 'General case' 0 C--O 1.226 -0.182 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.194 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 40.1 m -72.44 -44.18 62.76 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 111.533 0.197 . . . . 0.0 111.533 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 65.2 t -63.53 -48.43 86.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.416 ' HB2' ' CD1' ' A' ' 40' ' ' LEU . 68.7 m-85 -102.37 10.12 39.3 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -178.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.26 173.41 16.03 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.775 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.41 ' HB3' ' CG2' ' A' ' 33' ' ' THR . 0.0 OUTLIER -127.86 157.96 71.99 Favored Pre-proline 0 N--CA 1.464 0.229 0 O-C-N 122.814 -0.227 . . . . 0.0 110.763 179.93 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -89.34 153.3 30.54 Favored 'Cis proline' 0 C--N 1.35 0.611 0 C-N-CA 123.803 -1.332 . . . . 0.0 113.351 0.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.416 ' CD1' ' HB2' ' A' ' 36' ' ' PHE . 51.9 mt -138.32 159.17 42.74 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.134 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -114.16 134.88 54.6 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.706 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 50.7 mt -92.59 107.15 19.0 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.739 0.304 . . . . 0.0 110.834 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -113.78 129.58 56.56 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.279 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -108.27 124.3 50.11 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.477 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.0 ptm -126.18 130.83 51.77 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.855 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -89.92 -71.45 0.61 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.165 -179.525 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -142.13 -71.89 0.33 Allowed 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.553 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -117.53 16.73 14.61 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.128 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.1 mt -131.59 143.74 50.56 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.611 0.244 . . . . 0.0 110.924 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.67 126.61 54.69 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.93 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.8 mp -122.75 132.73 70.73 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.109 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.1 tt -102.69 135.66 43.93 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.798 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -109.13 110.22 21.41 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.914 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.56 -36.14 9.28 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.23 179.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -129.72 174.06 10.05 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.07 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -56.61 -33.86 66.67 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.028 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -54.44 -46.06 73.17 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 123.277 0.36 . . . . 0.0 110.956 179.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -61.92 -43.9 97.88 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.804 179.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 22.9 tp -69.01 -37.95 78.98 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.377 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -61.74 -43.09 99.53 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.935 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.58 -33.72 75.59 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.971 179.466 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.55 -35.63 80.08 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.402 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 13.4 mt -65.93 -44.91 92.33 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 CA-C-O 120.642 0.258 . . . . 0.0 110.468 179.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -41.63 89.14 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.948 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 11.0 mt -67.6 -41.68 85.92 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.111 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.9 tp -59.98 -47.32 86.29 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.85 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -67.63 -36.74 81.36 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.79 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 -66.21 -27.54 68.06 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.577 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 32.6 t -58.77 147.43 33.36 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.93 0.395 . . . . 0.0 111.629 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.6 p -71.33 -31.1 66.99 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.35 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.4 t -144.28 85.85 1.81 Allowed 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.955 0.407 . . . . 0.0 110.862 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 6.6 ttt -171.07 100.87 0.21 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.09 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.13 -35.1 10.12 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.234 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -98.54 159.02 15.23 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.61 0.243 . . . . 0.0 110.771 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.93 126.41 37.0 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.816 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -86.48 86.43 7.34 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.772 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 30.5 mm -104.15 128.22 57.75 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.052 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -114.58 118.74 34.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.688 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.18 131.9 54.18 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.456 179.773 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.1 pp -125.59 151.1 46.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.09 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.1 p -65.57 146.92 54.24 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.067 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 . . . . . 0 C--O 1.234 0.287 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 179.88 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 . . . . . 0 N--CA 1.467 0.416 0 CA-C-O 120.812 0.339 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.4 t -111.03 100.19 10.25 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.988 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.6 mtt180 -89.34 108.63 19.74 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.799 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 7.0 mt -106.46 134.59 47.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.216 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.9 mmtt -103.1 121.29 42.31 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.735 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -109.41 138.45 45.75 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.974 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -119.28 126.0 50.43 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.18 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -138.04 121.0 16.59 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.608 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 59.09 31.63 21.47 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.26 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.2 -35.78 3.98 Favored Glycine 0 C--N 1.337 0.638 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.775 -179.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -66.99 146.35 54.47 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.871 0.367 . . . . 0.0 111.219 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.6 mtm105 -113.51 147.18 38.39 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.361 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.94 136.28 40.3 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.087 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.6 mp -116.74 118.26 58.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.906 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.6 mt -127.98 136.49 60.13 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-O 120.863 0.363 . . . . 0.0 111.313 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.6 143.83 26.36 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.249 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -130.79 133.66 46.17 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.08 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.88 132.58 35.22 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.986 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.5 mtt180 -80.74 155.44 73.3 Favored Pre-proline 0 N--CA 1.464 0.226 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.087 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -72.75 124.68 9.44 Favored 'Cis proline' 0 C--N 1.349 0.579 0 C-N-CA 123.67 -1.388 . . . . 0.0 112.379 0.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.1 p -72.7 141.79 15.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.226 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.0 mmtt -118.59 128.44 54.56 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.9 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -57.41 -36.59 71.52 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.78 179.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.26 -44.77 94.2 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.089 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -69.05 -44.36 72.8 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.124 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 38.6 t -66.43 -47.47 83.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.151 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -61.47 -45.64 93.42 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.125 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -62.66 -45.2 93.91 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.723 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.36 -49.34 74.26 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.408 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 56.0 t -60.94 -42.65 93.65 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.377 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 92.1 m -61.98 -39.46 92.26 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.056 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.8 m -72.28 -41.4 66.73 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 111.6 0.222 . . . . 0.0 111.6 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 50.7 t -60.0 -52.49 60.57 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-O 120.575 0.226 . . . . 0.0 111.545 -179.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.419 ' CE2' HD21 ' A' ' 79' ' ' LEU . 87.3 m-85 -88.42 -23.24 23.37 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -179.047 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.417 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 104.25 -176.08 23.26 Favored Glycine 0 CA--C 1.523 0.588 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.371 -179.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -137.35 156.79 75.02 Favored Pre-proline 0 N--CA 1.466 0.349 0 CA-C-O 120.624 0.249 . . . . 0.0 111.134 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -85.85 140.17 26.64 Favored 'Cis proline' 0 C--N 1.349 0.574 0 C-N-CA 123.451 -1.479 . . . . 0.0 112.979 0.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.417 HD12 ' O ' ' A' ' 37' ' ' GLY . 21.8 mt -137.73 139.14 39.97 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.947 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -106.65 136.88 45.69 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.163 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 66.7 mt -86.54 108.74 18.7 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.048 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -112.23 119.96 40.13 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.899 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -106.33 130.06 54.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.562 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.1 ppp? -130.6 122.81 28.15 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.953 0.406 . . . . 0.0 110.937 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -79.12 -41.43 28.6 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.529 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -170.24 -67.18 0.02 OUTLIER 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.553 179.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -111.44 -24.64 10.05 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.634 179.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -105.74 138.77 41.38 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.656 0.265 . . . . 0.0 111.328 -179.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.0 t -110.09 131.06 55.39 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.711 179.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.3 mt -113.56 134.16 57.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.604 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.0 mt -84.47 118.04 24.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.034 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -86.33 100.0 11.99 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.312 179.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.6 mttt -135.22 25.22 3.53 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.932 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -173.5 157.18 3.17 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.653 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -61.09 -32.33 72.0 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.654 179.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.75 -45.82 81.77 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.888 179.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -60.47 -42.29 95.95 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.814 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 13.6 tp -66.71 -42.6 86.12 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.804 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.73 -38.88 92.23 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.379 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -39.93 95.67 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.804 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.99 -36.33 83.18 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.096 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 14.4 mt -65.18 -44.22 95.38 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.139 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.826 179.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -55.44 -45.78 76.77 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.082 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 10.7 mt -67.19 -40.44 85.15 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.607 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.0 -44.1 93.68 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.002 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -57.2 -34.58 68.65 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.183 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.2 mtp85 -73.66 -31.36 63.44 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.474 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.8 t -96.36 101.03 12.6 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.367 -179.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.7 t -59.74 -38.44 81.74 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.18 179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 56.3 p -59.12 -36.12 74.63 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.236 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.34 149.36 30.3 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.065 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.3 mttp -144.0 -47.23 0.27 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.148 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 95.4 p -101.89 167.65 9.93 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.95 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.1 mt -104.91 130.7 53.02 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.049 -179.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.33 81.26 8.43 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.938 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.3 mt -102.69 116.78 47.02 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.685 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 46.3 mt -101.95 117.34 34.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.614 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.419 HD21 ' CE2' ' A' ' 36' ' ' PHE . 1.8 pp -101.92 131.85 48.06 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.902 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.2 mp -129.35 155.12 46.14 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.027 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.75 146.31 54.93 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.913 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.19 0 CA-C-N 116.266 -0.425 . . . . 0.0 112.093 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 . . . . . 0 N--CA 1.468 0.437 0 CA-C-O 120.9 0.381 . . . . 0.0 111.308 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.2 t -108.56 128.59 64.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.447 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.6 mtt180 -89.88 113.23 24.8 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.796 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 3.0 mt -103.34 133.83 46.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.145 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -94.13 128.54 40.6 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.757 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -116.96 132.23 56.75 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.909 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -119.09 123.46 44.5 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.04 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 -129.35 118.0 21.53 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.734 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 57.92 33.68 23.47 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.472 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.67 -29.08 9.57 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.989 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -64.79 148.3 51.51 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.707 0.289 . . . . 0.0 111.131 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.2 mtp180 -120.35 134.55 55.24 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.136 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 50.8 mtp180 -142.99 149.61 38.54 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.305 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.0 mt -114.46 133.76 59.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.242 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 23.8 mt -137.58 130.76 42.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.209 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.78 141.34 28.55 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.199 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -137.48 132.42 33.28 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.132 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.5 m -84.55 125.41 32.39 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.869 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 54.9 mtm180 -89.44 154.67 48.78 Favored Pre-proline 0 CA--C 1.529 0.155 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.116 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -74.61 121.07 6.98 Favored 'Cis proline' 0 C--N 1.351 0.663 0 C-N-CA 123.725 -1.365 . . . . 0.0 112.506 0.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.8 p -101.77 131.36 49.84 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.8 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp -78.28 144.56 36.03 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.825 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -56.77 -39.56 74.28 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.79 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.404 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -62.9 -36.01 81.95 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.15 179.696 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -67.92 -44.1 77.65 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 116.697 -0.228 . . . . 0.0 110.98 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 31.6 t -63.84 -47.33 91.26 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.956 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.404 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 13.0 pt-20 -66.75 -35.08 79.27 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.085 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -56.43 -45.39 80.77 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.628 0.251 . . . . 0.0 110.852 179.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.4 mmmt -68.25 -49.26 61.82 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.91 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.1 t -61.25 -40.67 86.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.477 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 98.1 m -66.45 -41.72 88.67 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.069 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.3 m -72.63 -43.53 63.11 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 111.68 0.252 . . . . 0.0 111.68 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.7 t -66.28 -44.06 91.33 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -179.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -103.46 10.88 37.03 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -179.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.02 171.16 10.76 Favored Glycine 0 C--N 1.338 0.673 0 C-N-CA 120.736 -0.745 . . . . 0.0 113.057 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -120.29 159.19 48.65 Favored Pre-proline 0 N--CA 1.466 0.337 0 O-C-N 122.821 -0.223 . . . . 0.0 110.785 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -89.05 153.69 32.31 Favored 'Cis proline' 0 C--N 1.351 0.662 0 C-N-CA 123.846 -1.314 . . . . 0.0 113.477 0.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 48.3 mt -138.19 133.17 32.92 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.977 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -105.77 134.78 48.34 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.808 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.2 102.71 14.75 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.146 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -101.5 122.12 43.22 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.229 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -103.78 130.52 51.32 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.725 179.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 8.3 mtt -117.22 124.12 48.3 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.623 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -84.92 -61.92 1.66 Allowed 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.225 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -164.12 -64.12 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.694 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -112.83 -13.38 13.19 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.524 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.7 tp -120.44 143.76 48.32 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-O 120.69 0.281 . . . . 0.0 111.319 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.4 m -100.89 124.71 46.98 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.751 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.4 mt -118.59 133.51 65.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.001 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 14.1 tp -103.38 134.5 46.65 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.84 179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.6 mp -84.89 84.31 7.75 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.751 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -90.28 -35.11 15.47 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.207 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -120.86 159.65 25.06 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.914 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.5 tm0? -60.16 -33.75 72.61 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.962 179.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.57 -40.61 79.32 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.093 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.67 -42.72 97.63 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.778 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 tp -68.46 -40.06 81.18 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.953 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.33 -43.38 98.96 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.075 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.68 -35.74 79.39 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.85 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.64 -40.21 96.31 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.542 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 13.8 mt -64.16 -41.17 91.59 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 116.732 -0.213 . . . . 0.0 111.008 179.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -54.84 -40.13 69.29 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.028 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 44.4 mt -67.85 -42.01 85.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.811 179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.4 tp -65.54 -45.88 81.73 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.729 179.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.56 -39.63 77.12 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.105 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.1 mmt-85 -61.93 -34.37 75.96 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.213 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 42.5 t -84.8 105.26 15.45 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.907 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 85.6 p -67.59 -32.16 72.72 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.017 179.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.2 t -67.32 -43.14 82.35 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.953 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.42 120.98 25.68 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.103 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.46 -40.09 4.74 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.185 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 53.6 p -91.6 167.51 12.16 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.66 -0.246 . . . . 0.0 111.111 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -107.57 131.12 54.69 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.23 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -91.41 86.8 6.2 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.69 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 29.4 mt -117.95 129.3 74.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.004 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.99 117.58 32.44 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.836 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.0 131.04 45.34 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.97 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 pp -122.93 130.57 53.0 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.705 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.4 t -75.99 135.7 40.0 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.767 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 34.8 tp60 . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.989 179.659 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.233 0.208 0 CA-C-O 121.006 0.432 . . . . 0.0 110.498 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 38.2 t -77.68 128.89 37.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.584 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 23.2 mtm180 -93.14 115.59 28.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.805 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 24.7 mt -108.31 128.68 63.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.856 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 39.4 mttt -106.23 126.99 52.9 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.009 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.407 ' CZ ' HG21 ' A' ' 32' ' ' VAL . 89.2 m-85 -114.43 143.28 45.17 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.083 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -128.02 127.99 44.18 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.997 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.0 t-160 -143.1 118.88 10.51 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.602 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 58.4 37.29 25.79 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.345 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 91.57 -47.14 2.78 Favored Glycine 0 C--N 1.334 0.437 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.719 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.49 141.14 52.0 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.733 0.301 . . . . 0.0 110.92 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -125.06 149.75 47.49 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.323 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.51 139.46 50.5 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.948 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.4 mp -99.73 133.23 43.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.954 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 9.1 tp -129.46 137.58 56.51 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.395 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.87 131.38 35.83 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.994 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -132.34 125.81 31.77 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.228 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.4 m -98.86 142.84 29.87 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.882 179.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 68.4 mtt180 -74.02 151.15 88.32 Favored Pre-proline 0 N--CA 1.464 0.245 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.948 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.75 125.87 12.47 Favored 'Cis proline' 0 C--N 1.352 0.715 0 C-N-CA 123.474 -1.469 . . . . 0.0 112.658 0.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.9 p -89.61 114.94 28.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.077 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -99.66 137.16 38.53 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.106 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -56.47 -40.31 74.64 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.141 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -63.57 -44.75 93.17 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.101 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -66.36 -44.28 83.62 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.374 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 43.1 t -65.35 -47.66 86.19 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.721 179.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -59.89 -42.66 94.31 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.095 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.82 -42.4 79.53 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.056 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.9 mtpt -69.49 -49.63 52.92 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.028 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.407 HG21 ' CZ ' ' A' ' 8' ' ' PHE . 34.9 t -61.3 -40.55 86.49 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.441 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 88.5 m -59.3 -41.73 89.69 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.844 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 48.7 m -72.13 -31.76 66.3 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 111.464 0.172 . . . . 0.0 111.464 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.1 t -63.95 -55.88 19.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 111.632 0.234 . . . . 0.0 111.632 -179.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.459 ' HB2' HD13 ' A' ' 40' ' ' LEU . 77.7 m-85 -97.56 -10.66 24.8 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 -178.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.97 -172.41 24.55 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.475 -179.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -143.65 156.81 59.6 Favored Pre-proline 0 N--CA 1.465 0.277 0 O-C-N 122.83 -0.218 . . . . 0.0 111.338 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -81.44 153.31 80.08 Favored 'Cis proline' 0 C--N 1.35 0.636 0 C-N-CA 123.803 -1.332 . . . . 0.0 112.884 0.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.459 HD13 ' HB2' ' A' ' 36' ' ' PHE . 48.0 mt -136.01 149.08 48.69 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.029 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -116.0 120.23 38.47 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.793 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 73.2 mt -81.95 97.29 8.01 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.727 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -97.9 113.71 25.61 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.286 -179.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 14.1 t80 -98.85 123.56 43.19 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.717 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.4 mtt -126.23 131.86 51.85 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.673 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -76.91 -43.92 33.73 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.631 179.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -173.93 -49.85 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.605 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -119.34 -36.58 3.33 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.375 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.8 mp -95.26 134.14 38.36 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.827 0.346 . . . . 0.0 111.24 -179.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 98.1 p -105.04 121.2 43.29 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.844 179.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.4 mt -114.75 132.49 63.77 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.86 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.9 tt -88.26 132.91 34.2 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.658 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.4 mt -103.01 94.67 5.67 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.69 179.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.07 27.66 9.38 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.486 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -173.45 164.92 4.65 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.919 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.42 -37.15 86.53 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.548 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -58.51 -40.9 84.16 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.653 -0.249 . . . . 0.0 110.909 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -65.79 -43.79 87.67 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.781 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.2 tp -67.21 -41.76 85.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.802 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -63.85 -43.1 97.16 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.932 179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.4 tttm -63.87 -32.13 73.54 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.411 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.77 -40.38 97.09 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.389 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 5.0 mt -64.42 -40.92 90.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.935 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -55.32 -34.95 64.62 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.001 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 41.7 mt -65.96 -40.92 88.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.085 179.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.4 tp -65.33 -45.02 85.93 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.768 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -56.97 -39.42 74.57 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.608 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -65.05 -32.76 74.64 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.203 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.5 t -70.04 146.5 50.95 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.809 0.338 . . . . 0.0 111.278 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 2.3 m -76.3 -34.82 59.06 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.426 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.3 p -77.79 -52.23 9.24 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.285 -179.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 13.9 ptt? 40.56 86.46 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.547 0 O-C-N 123.484 0.49 . . . . 0.0 112.223 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.09 82.78 2.07 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.961 0.41 . . . . 0.0 111.173 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 63.28 -179.37 0.15 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.44 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -122.31 122.47 39.15 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.077 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.3 mtt180 -83.4 93.81 7.84 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.004 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.3 mt -109.06 128.09 65.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.869 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.5 mp -103.64 126.45 50.79 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.192 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.8 pp -111.13 136.22 50.5 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.786 0.327 . . . . 0.0 111.169 179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.1 mp -128.95 155.38 45.42 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.976 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.9 141.44 29.57 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.162 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.466 0.328 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.995 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.402 0 CA-C-O 120.951 0.405 . . . . 0.0 111.064 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.8 t -84.27 124.42 39.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.033 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.36 117.44 29.91 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.858 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.3 mt -103.64 130.42 54.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.12 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 tmtt? -110.55 114.42 27.82 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.711 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 12.2 p90 -113.34 146.96 38.58 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.079 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -124.48 143.95 50.37 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.106 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -140.39 111.84 7.3 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.678 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 54.58 34.49 21.4 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.645 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 104.75 -42.48 1.89 Allowed Glycine 0 C--N 1.334 0.459 0 C-N-CA 120.921 -0.657 . . . . 0.0 112.741 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.55 135.46 56.02 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.689 0.28 . . . . 0.0 111.076 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -115.05 154.08 29.52 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.596 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -151.79 136.37 16.98 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.157 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.7 mt -114.38 126.56 71.94 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.135 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 26.2 mm -130.63 131.13 64.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.12 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.66 134.05 39.01 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.13 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -126.94 124.19 38.92 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.201 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -80.87 150.26 29.15 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.052 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.42 152.01 43.26 Favored Pre-proline 0 CA--C 1.532 0.274 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.256 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -76.04 131.3 23.82 Favored 'Cis proline' 0 C--N 1.35 0.629 0 C-N-CA 123.233 -1.57 . . . . 0.0 112.318 -0.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.9 p -119.96 123.55 71.04 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.043 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.7 mttp -91.79 151.09 20.76 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.08 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -62.65 -35.99 81.42 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.895 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -63.37 -44.66 94.14 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.987 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.67 -44.4 93.88 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.392 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 39.4 t -67.73 -47.62 79.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 120.777 0.322 . . . . 0.0 110.685 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -63.42 -44.5 94.42 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.36 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -56.33 -39.04 72.17 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.471 -179.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.7 tttt -64.13 -47.58 79.39 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-O 120.64 0.257 . . . . 0.0 110.556 179.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 20.7 t -63.52 -40.25 88.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.691 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -59.28 -40.69 86.91 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 116.856 -0.156 . . . . 0.0 111.112 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.9 m -72.47 -33.25 66.87 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.436 0.16 . . . . 0.0 111.088 179.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 44.7 t -68.03 -53.1 32.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -99.85 9.12 43.52 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.86 176.46 26.41 Favored Glycine 0 C--N 1.335 0.524 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.877 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -124.35 158.54 60.95 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-O 120.467 0.175 . . . . 0.0 110.944 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -90.07 153.51 27.53 Favored 'Cis proline' 0 C--N 1.348 0.526 0 C-N-CA 123.901 -1.291 . . . . 0.0 113.175 0.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.4 HD21 ' CB ' ' A' ' 81' ' ' SER . 78.1 mt -138.54 148.35 44.14 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.942 179.573 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -115.16 123.58 49.28 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.663 179.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 81.1 mt -88.32 102.01 14.44 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.182 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -96.59 122.01 39.05 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.024 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -104.3 119.04 38.07 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.47 179.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 27.6 mmm -94.32 130.97 40.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.768 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -82.5 -50.39 8.89 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.874 0.369 . . . . 0.0 110.348 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -172.41 -63.51 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.009 179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -107.14 -28.95 9.65 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.485 179.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.6 mt -109.12 162.98 13.75 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.919 0.39 . . . . 0.0 111.525 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.24 125.39 53.04 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.186 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.6 mm -116.61 132.7 65.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.944 179.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 37.6 tp -94.75 126.55 40.14 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.841 179.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 15.6 mt -79.93 131.67 35.88 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.727 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.4 mmtt -108.04 -38.39 5.8 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.393 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 39.3 p30 -152.78 -172.3 4.2 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.041 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -55.98 -36.35 67.77 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.974 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.73 -44.99 70.35 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.859 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.64 -35.38 80.63 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.871 179.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.5 tp -72.91 -38.37 66.92 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.145 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -62.28 -43.38 98.96 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.263 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.3 ptpt -69.23 -30.77 68.99 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.808 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.24 -39.4 94.49 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.294 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 21.6 mt -62.95 -40.89 90.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.838 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -55.82 -38.42 69.98 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.082 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 31.9 mm -68.77 -38.02 78.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.96 179.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.3 tp -62.28 -36.95 83.67 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.027 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.41 ' HA ' ' HG3' ' A' ' 72' ' ' MET . 14.6 t70 -57.9 -36.89 73.06 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.956 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 9.2 mtt-85 -65.74 -32.38 73.9 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.833 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 26.2 t -68.66 165.06 20.16 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.147 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.95 -37.73 38.85 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.861 -179.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.82 -69.75 0.27 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.649 -0.251 . . . . 0.0 111.483 -179.295 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.41 ' HG3' ' HA ' ' A' ' 67' ' ' ASP . 2.0 ttm 53.83 30.49 11.47 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 120.759 0.314 . . . . 0.0 111.422 -179.711 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.7 mmpt? -117.8 -31.25 5.19 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.687 -0.233 . . . . 0.0 111.28 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.2 p -126.53 165.57 18.88 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.928 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -113.5 122.25 46.7 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.626 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.2 mtt-85 -82.95 93.62 7.57 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 120.837 0.351 . . . . 0.0 110.762 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 17.2 mt -126.11 131.43 71.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.133 -179.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.8 tp -115.27 117.04 29.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.522 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.8 pp -110.57 135.41 51.25 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.768 0.318 . . . . 0.0 110.952 179.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.1 mt -135.74 154.14 51.34 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.677 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' SER . . . . . 0.4 ' CB ' HD21 ' A' ' 40' ' ' LEU . 6.2 t -89.67 145.07 25.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.984 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.277 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 . . . . . 0 N--CA 1.466 0.355 0 CA-C-O 120.809 0.338 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.2 t -108.56 123.7 64.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.334 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.91 106.62 18.52 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.594 179.687 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 23.0 mt -107.09 124.69 63.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.123 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.6 116.98 33.96 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.764 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -104.27 139.92 38.59 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.943 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -123.37 132.25 53.91 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.95 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -142.12 117.05 9.92 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.786 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 57.97 35.62 25.44 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.335 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.06 -35.46 4.17 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.839 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -64.8 135.99 56.4 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.737 0.268 . . . . 0.0 110.932 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -117.35 140.18 49.9 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.22 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 25.1 mtt-85 -148.25 136.4 21.16 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.234 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.5 mt -105.14 125.04 60.24 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.233 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.418 HD13 HG23 ' A' ' 17' ' ' ILE . 26.0 mm -115.78 133.08 63.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.104 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.4 132.16 37.91 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.104 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -128.01 146.03 50.79 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.196 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.52 141.73 28.41 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.998 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.8 mtm180 -98.2 138.6 20.9 Favored Pre-proline 0 C--O 1.233 0.192 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.017 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -75.14 146.93 87.8 Favored 'Cis proline' 0 C--N 1.35 0.615 0 C-N-CA 123.773 -1.345 . . . . 0.0 112.446 0.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.4 p -117.56 121.03 66.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 120.918 0.39 . . . . 0.0 111.008 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.58 130.62 39.1 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.875 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -55.31 -35.76 65.48 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.983 179.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -60.72 -42.37 97.14 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.879 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -67.91 -43.12 79.96 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.919 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.2 t -61.96 -47.02 95.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.95 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' ' 30' ' ' HIS . 10.5 pt-20 -65.72 -42.27 91.26 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.927 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . 0.431 ' N ' ' HG3' ' A' ' 29' ' ' GLU . 0.8 OUTLIER -56.47 -42.48 78.3 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.233 -179.971 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.9 tttt -70.25 -49.16 52.72 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.051 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 24.4 t -63.19 -40.75 90.22 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.388 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.3 m -58.56 -42.56 88.23 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.057 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.1 m -72.31 -35.29 68.61 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 120.484 0.183 . . . . 0.0 111.452 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 49.1 t -67.69 -50.71 58.13 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -179.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -103.97 10.92 36.01 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -179.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.63 172.4 9.39 Favored Glycine 0 CA--C 1.523 0.545 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.906 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -128.63 158.82 70.81 Favored Pre-proline 0 N--CA 1.463 0.213 0 CA-C-O 120.457 0.17 . . . . 0.0 110.709 179.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -87.57 153.88 41.46 Favored 'Cis proline' 0 C--N 1.35 0.638 0 C-N-CA 123.834 -1.319 . . . . 0.0 113.441 0.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 47.6 mt -138.93 155.69 47.84 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.703 179.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -114.54 134.12 55.27 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.842 0.353 . . . . 0.0 110.83 179.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.4 mp -91.39 103.75 16.35 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.943 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.41 ' CD2' ' HB2' ' A' ' 50' ' ' SER . 0.1 OUTLIER -111.15 122.18 47.22 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.337 -179.552 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.424 ' HB3' HD11 ' A' ' 53' ' ' LEU . 13.4 t80 -124.32 130.52 52.66 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.699 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.43 133.14 49.97 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.799 179.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -63.74 -56.23 17.21 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.735 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -157.43 -53.94 0.07 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.583 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -127.04 7.79 6.64 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.522 179.459 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.2 mt -131.39 138.65 49.21 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.474 0.178 . . . . 0.0 110.895 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.41 ' HB2' ' CD2' ' A' ' 43' ' ' HIS . 29.9 p -110.33 131.62 54.89 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.964 179.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 24.4 mt -130.28 134.62 62.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.974 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.8 133.55 33.98 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.925 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.424 HD11 ' HB3' ' A' ' 44' ' ' TYR . 0.2 OUTLIER -126.26 87.98 2.76 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.773 179.916 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -109.12 26.72 10.3 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.988 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -154.7 154.16 32.44 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.774 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.0 tp60 -60.55 -34.03 73.55 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.853 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -59.7 -50.63 73.12 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.02 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.05 -42.91 99.68 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.841 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 15.1 tp -60.93 -40.75 94.4 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.01 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.63 -41.53 97.61 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.908 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 15.6 mtpt -63.5 -36.84 85.08 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.77 -36.45 83.13 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.106 179.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 39.3 mt -60.16 -44.01 94.33 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.962 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -54.4 -41.31 69.13 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.967 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 46.2 mt -65.18 -46.21 91.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.019 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.1 mt -63.06 -39.35 94.47 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.914 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -57.99 -37.33 74.05 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.11 179.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.3 mmt180 -62.25 -35.13 78.01 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.206 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 33.1 t -88.76 112.19 22.89 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.123 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.2 m -72.6 -33.72 66.91 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.898 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.7 p -74.82 -37.08 62.4 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.491 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -90.37 111.92 23.33 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.085 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.6 pttt -126.41 32.17 5.24 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.932 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 61.4 p -146.64 153.64 40.54 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.121 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.5 mp -104.07 116.76 32.81 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.12 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 -90.17 91.86 8.71 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.698 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.8 mt -110.31 122.75 65.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.004 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -105.83 117.56 34.34 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.767 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.6 pp -109.38 133.22 53.33 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.788 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.1 pp -118.07 154.62 31.76 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.841 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 25.9 m -97.06 135.57 38.86 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.76 -179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.285 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.584 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . 0.403 ' OD1' ' HB3' ' A' ' 18' ' ' ALA . 3.7 t70 . . . . . 0 N--CA 1.466 0.366 0 CA-C-O 121.043 0.449 . . . . 0.0 111.207 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.4 t -128.32 137.77 56.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.152 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.55 116.08 28.49 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.432 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.416 HG21 ' CE2' ' A' ' 8' ' ' PHE . 4.0 mp -117.67 131.15 71.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.974 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 26.6 tttt -106.63 129.18 54.59 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.929 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.416 ' CE2' HG21 ' A' ' 6' ' ' ILE . 83.1 m-85 -114.73 134.41 55.12 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.881 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -119.21 123.85 45.33 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.962 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.4 t-160 -134.81 115.9 14.2 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.624 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 57.93 32.53 22.07 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.301 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 96.06 -34.77 4.72 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.995 -0.622 . . . . 0.0 112.699 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -65.02 136.41 56.75 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.703 0.287 . . . . 0.0 110.932 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 40.9 mtm-85 -108.61 138.78 44.36 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.158 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -132.81 127.83 35.39 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.798 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.8 mp -110.39 123.95 66.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.923 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 33.6 mt -137.44 131.81 44.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 121.029 0.442 . . . . 0.0 111.034 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.403 ' HB3' ' OD1' ' A' ' 3' ' ' ASP . . . -92.03 134.04 35.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.696 -0.683 . . . . 0.0 111.122 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -116.21 119.26 35.2 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.767 179.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 93.2 p -74.9 131.18 40.51 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.912 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.3 mtm180 -73.95 151.78 88.6 Favored Pre-proline 0 N--CA 1.463 0.223 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.288 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.14 166.18 82.93 Favored 'Cis proline' 0 C--N 1.351 0.668 0 C-N-CA 123.562 -1.433 . . . . 0.0 112.845 0.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.5 p -152.63 153.17 9.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.239 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.31 164.17 28.01 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.491 -179.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -56.92 -44.65 82.66 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.264 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -58.09 -45.15 87.65 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.396 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -67.03 -44.42 80.28 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.572 -179.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 40.0 t -67.9 -46.99 81.01 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.065 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -63.45 -41.49 98.65 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.388 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.6 m80 -56.68 -40.89 76.37 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.641 0.258 . . . . 0.0 111.059 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.78 -49.07 56.44 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.257 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 46.4 t -65.39 -42.57 93.83 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 CA-C-N 116.693 -0.231 . . . . 0.0 111.516 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.424 HG22 ' HB3' ' A' ' 38' ' ' GLN . 75.0 m -59.06 -39.67 82.79 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.725 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 29.7 m -72.15 -32.47 66.92 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 121.247 -0.181 . . . . 0.0 111.331 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.4 t -66.87 -58.28 7.01 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 N-CA-C 111.435 0.161 . . . . 0.0 111.435 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.439 ' HB2' ' CD1' ' A' ' 40' ' ' LEU . 33.0 m-85 -95.85 6.78 48.07 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -179.157 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.09 -176.29 54.72 Favored Glycine 0 C--N 1.336 0.546 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.693 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.424 ' HB3' HG22 ' A' ' 33' ' ' THR . 0.4 OUTLIER -131.28 155.87 80.91 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 120.561 0.22 . . . . 0.0 111.068 -179.9 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -90.61 153.72 25.34 Favored 'Cis proline' 0 C--N 1.349 0.601 0 C-N-CA 123.744 -1.357 . . . . 0.0 113.273 0.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.439 ' CD1' ' HB2' ' A' ' 36' ' ' PHE . 21.5 mt -137.41 141.79 41.67 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.933 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -114.33 127.63 55.95 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.936 179.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 21.0 mt -92.66 112.84 24.94 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.829 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.423 ' CD2' HD11 ' A' ' 52' ' ' LEU . 10.0 t-160 -110.54 120.65 43.11 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.156 -179.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.434 ' HB2' ' CD2' ' A' ' 53' ' ' LEU . 1.2 t80 -88.76 130.33 35.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.842 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.6 mpp? -126.93 113.96 17.21 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.547 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -72.77 -53.98 10.13 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.733 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -176.68 -56.62 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.343 179.78 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -107.21 -26.79 10.91 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.536 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -114.04 155.61 25.62 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.882 0.372 . . . . 0.0 111.495 -179.576 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -118.12 124.94 49.25 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.839 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 9.6 mt -113.87 133.12 60.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.046 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.423 HD11 ' CD2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -96.84 135.87 38.2 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.806 179.825 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.434 ' CD2' ' HB2' ' A' ' 44' ' ' TYR . 1.0 OUTLIER -95.33 76.68 3.4 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.617 179.915 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 3.0 pttp -77.37 -35.34 54.59 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.489 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -123.14 165.06 17.48 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.075 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.8 tm0? -59.94 -35.86 75.82 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.807 179.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -53.81 -49.88 67.37 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.91 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -59.17 -46.0 89.55 Favored 'General case' 0 N--CA 1.461 0.125 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.148 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.3 tp -66.15 -41.86 89.83 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.885 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -66.27 -42.34 88.62 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.395 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -62.75 -36.52 83.31 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.45 179.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.81 -39.14 93.52 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.205 179.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.2 mt -64.53 -42.78 96.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.798 179.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.11 -37.69 67.18 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.945 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 9.5 mt -65.86 -41.69 90.6 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.879 179.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.9 tt -61.42 -44.21 97.53 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.865 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.79 -34.41 78.28 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.076 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -67.32 -32.63 73.72 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.406 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.7 t -103.92 109.05 20.66 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.294 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 47.5 t -77.7 -9.17 58.84 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.3 p -89.65 42.53 1.1 Allowed 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 120.758 0.313 . . . . 0.0 111.66 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.81 -173.67 3.63 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.691 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.7 mttm -130.87 -69.05 0.66 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.652 0.263 . . . . 0.0 111.012 179.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -130.52 -173.01 2.95 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.058 -179.677 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.9 mp -91.9 121.54 33.59 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.452 179.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.9 tpt180 -76.81 80.34 3.41 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.002 0.429 . . . . 0.0 110.74 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.5 mt -103.93 123.24 57.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.754 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -103.29 117.29 34.17 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.819 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.1 pp -105.7 127.77 53.27 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.568 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.3 mp -119.82 127.62 52.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.127 -179.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -98.2 131.17 44.78 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.986 179.616 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.354 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.49 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 . . . . . 0 N--CA 1.466 0.341 0 CA-C-O 120.901 0.381 . . . . 0.0 110.87 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 23.2 t -78.48 130.08 36.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.348 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -87.76 123.58 32.71 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.928 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 3.1 mt -118.06 124.53 73.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.643 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.7 mttp -95.07 121.24 36.5 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.796 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -113.15 131.72 55.74 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.689 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -119.22 127.91 53.71 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.182 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 12.9 t-160 -130.98 117.19 18.84 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.522 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 56.33 32.27 20.16 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.548 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 96.26 -28.08 14.43 Favored Glycine 0 C--N 1.335 0.508 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.012 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.5 148.19 52.15 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.829 0.347 . . . . 0.0 111.273 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.7 ptp85 -109.07 142.59 39.56 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.113 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -141.87 139.95 32.76 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.227 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.1 mp -115.38 131.72 66.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.233 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.405 HD13 HG22 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -145.34 131.38 14.15 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.237 -179.944 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -103.88 127.68 51.38 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.059 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -113.28 120.7 42.09 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.087 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.3 m -82.55 128.53 34.39 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.931 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.0 mtm180 -78.33 156.8 78.53 Favored Pre-proline 0 N--CA 1.464 0.233 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.912 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.68 126.37 12.89 Favored 'Cis proline' 0 C--N 1.351 0.667 0 C-N-CA 123.566 -1.431 . . . . 0.0 112.667 -0.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.1 p -103.25 147.05 10.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.454 -179.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.66 146.11 36.77 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.109 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -59.68 -39.6 85.04 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.629 179.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -43.83 98.14 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.837 179.682 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -64.96 -44.34 89.7 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.425 -179.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 43.1 t -68.18 -47.3 78.89 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.125 0 CA-C-O 120.605 0.24 . . . . 0.0 111.156 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -64.28 -45.45 87.98 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.136 -179.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -58.95 -44.36 91.43 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.752 0.31 . . . . 0.0 110.596 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.2 tttt -64.05 -49.47 72.23 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.228 179.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 43.6 t -64.09 -41.05 91.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-N 116.764 -0.198 . . . . 0.0 111.323 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 95.9 m -61.34 -39.5 90.79 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.993 179.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.3 m -72.42 -40.97 66.73 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 121.137 -0.225 . . . . 0.0 111.344 179.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.3 t -64.84 -55.1 22.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.173 0 CA-C-O 120.67 0.271 . . . . 0.0 111.353 -179.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -85.95 -7.45 58.66 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -179.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.03 177.15 50.01 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.571 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.94 154.43 79.22 Favored Pre-proline 0 N--CA 1.465 0.301 0 CA-C-O 120.571 0.224 . . . . 0.0 111.044 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -86.91 153.52 45.12 Favored 'Cis proline' 0 C--N 1.349 0.59 0 C-N-CA 123.655 -1.394 . . . . 0.0 113.449 0.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 32.6 mt -138.38 157.1 46.89 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.923 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -114.43 118.44 33.83 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.002 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 37.5 mt -79.84 100.1 7.84 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.892 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.4 m170 -103.73 112.26 25.13 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.874 0.369 . . . . 0.0 111.247 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -94.96 115.89 28.02 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.23 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.3 ttm -101.84 124.95 48.34 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.986 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -79.56 -41.1 27.95 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.712 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -171.81 -64.17 0.02 OUTLIER 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.334 179.675 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.81 -29.49 7.95 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.576 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -107.2 155.3 20.05 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.852 0.358 . . . . 0.0 111.291 -179.42 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.6 t -114.81 132.95 56.31 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.983 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 28.9 mt -125.39 134.34 67.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.694 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.5 tt -83.14 132.71 35.07 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.652 0.263 . . . . 0.0 111.093 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.1 mt -87.27 110.67 20.36 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.64 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.07 -64.06 1.18 Allowed 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.45 -179.545 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -136.13 -169.04 2.34 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.82 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -54.12 -30.77 50.1 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -54.14 -42.31 69.38 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.62 0.247 . . . . 0.0 111.119 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.42 -48.46 69.96 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.806 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.3 tt -64.23 -39.63 94.37 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.201 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -61.81 -43.28 99.16 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.746 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.19 -36.33 83.7 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.643 179.311 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.68 -38.95 92.38 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.327 179.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 13.6 mt -64.35 -44.4 97.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.8 0.333 . . . . 0.0 110.642 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -56.48 -42.82 78.9 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.053 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 27.2 mt -69.19 -38.33 77.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.805 179.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 9.6 tp -60.5 -46.0 91.72 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.865 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -60.61 -36.15 77.87 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.718 179.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.6 ttm-85 -63.15 -33.0 74.52 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.28 179.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 31.1 t -72.3 150.9 43.14 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 120.664 0.269 . . . . 0.0 111.219 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 4.4 m -81.03 -33.04 33.86 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.493 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.0 p -74.07 -69.22 0.46 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.67 -0.241 . . . . 0.0 111.532 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.7 ttt 54.14 81.41 0.1 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.872 0.368 . . . . 0.0 111.016 -179.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.6 ptpt -128.78 85.63 2.35 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.001 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.5 t 66.06 -179.83 0.2 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.384 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.7 mp -109.49 131.55 54.96 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.114 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.7 mtt85 -87.64 88.15 7.59 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.993 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.445 HD11 HG23 ' A' ' 77' ' ' ILE . 23.1 mt -122.39 127.31 75.06 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.132 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.931 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -116.62 117.43 29.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.858 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.9 pp -96.2 127.97 42.69 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.804 0.335 . . . . 0.0 110.764 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.3 mp -112.79 147.51 36.76 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.353 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.3 p -95.1 147.47 23.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.824 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 . . . . . 0 C--O 1.235 0.294 0 CA-C-N 116.227 -0.442 . . . . 0.0 112.03 -179.979 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.467 0.406 0 CA-C-O 120.955 0.407 . . . . 0.0 111.145 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 15.4 t -106.3 128.98 60.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.336 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -86.88 115.85 24.56 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.676 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 20.1 mm -104.74 125.69 59.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.134 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.8 ttmt -100.92 116.15 32.11 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.636 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -109.55 132.61 53.97 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.717 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -119.51 133.61 55.6 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.196 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -141.11 116.11 9.84 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.81 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 34.8 m-20 56.05 35.66 25.99 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.339 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.45 -27.93 12.44 Favored Glycine 0 CA--C 1.525 0.677 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.963 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.55 150.16 47.35 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.715 0.257 . . . . 0.0 111.145 179.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.6 mtm-85 -125.75 143.82 50.89 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.397 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.23 132.36 16.34 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.165 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.5 mt -109.3 122.97 64.79 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.742 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 26.4 mt -133.08 130.18 57.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.122 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -97.54 131.18 44.38 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.098 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -112.96 117.04 30.97 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.745 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.85 140.1 47.37 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.846 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.47 150.91 95.68 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.978 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.74 132.44 26.91 Favored 'Cis proline' 0 C--N 1.35 0.606 0 C-N-CA 123.298 -1.543 . . . . 0.0 112.731 0.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.6 p -89.64 124.43 42.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.718 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 6.4 mttt -113.21 134.47 54.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.941 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -56.54 -46.46 80.65 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.076 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.22 -44.91 88.43 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.025 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -65.12 -44.67 87.96 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.304 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 45.4 t -67.71 -47.26 80.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.777 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -59.71 -44.29 93.78 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.653 179.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 3.7 t60 -57.89 -38.91 76.66 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.239 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.82 -49.96 47.58 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.799 -0.182 . . . . 0.0 111.099 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.8 t -67.49 -43.33 87.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.9 t -59.8 -39.1 83.84 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.526 -179.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.3 m -72.12 -39.9 68.52 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 111.474 0.176 . . . . 0.0 111.474 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.8 t -60.66 -55.75 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 120.508 0.194 . . . . 0.0 111.314 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -84.6 -20.06 32.04 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -179.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.4 178.22 41.38 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.6 -179.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -126.38 160.2 59.08 Favored Pre-proline 0 CA--C 1.53 0.201 0 CA-C-O 120.586 0.232 . . . . 0.0 110.85 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -83.82 146.34 52.36 Favored 'Cis proline' 0 C--N 1.351 0.686 0 C-N-CA 123.521 -1.45 . . . . 0.0 113.221 0.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 17.3 mt -137.52 146.58 44.35 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.918 179.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -116.35 134.51 54.81 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.165 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.33 114.51 27.06 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.876 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -114.3 111.58 21.72 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.073 -179.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 16.8 t80 -93.4 121.9 35.26 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.276 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.1 ptt? -123.98 132.2 53.67 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.843 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -97.51 -47.89 5.49 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.358 179.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -163.72 -71.32 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.26 179.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -109.85 -25.72 10.17 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.453 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -103.6 140.74 37.14 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.76 0.314 . . . . 0.0 111.256 -179.607 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.3 m -112.37 132.25 55.11 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.698 179.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.41 HG23 HD13 ' A' ' 51' ' ' ILE . 30.0 mm -114.54 133.87 59.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.774 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.21 120.71 32.36 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.853 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 40.5 mt -104.61 125.27 50.58 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.57 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.2 ttmp? -128.5 -55.73 1.24 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.971 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.4 m-20 -104.53 174.58 5.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.792 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -58.98 -33.9 71.2 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.944 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.95 -48.53 67.28 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 120.579 0.228 . . . . 0.0 111.279 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -63.26 -47.19 83.4 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.564 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 20.5 tp -63.43 -40.23 96.61 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.44 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -61.48 -43.3 99.1 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.607 -0.27 . . . . 0.0 110.813 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -34.72 78.76 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.814 179.291 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.99 -35.23 79.52 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.138 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 31.3 mm -59.64 -46.52 93.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.473 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -53.16 -43.51 67.09 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.849 179.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 32.3 mt -65.24 -43.15 95.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.311 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.24 -48.09 62.85 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.886 0.374 . . . . 0.0 110.728 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.03 -40.33 76.52 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.6 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 37.3 ptt85 -69.02 -29.7 67.93 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 111.58 0.215 . . . . 0.0 111.58 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 64.7 p -76.12 116.75 17.13 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 120.732 0.301 . . . . 0.0 110.828 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 50.5 p -74.4 -48.97 24.49 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.246 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.17 -48.06 77.45 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.283 -179.622 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.06 145.64 49.77 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.016 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.9 mttp -136.66 -51.93 0.69 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.074 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.1 166.1 21.01 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.886 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -101.05 126.67 47.75 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.182 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.0 mtt180 -93.33 81.99 4.46 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.05 0.453 . . . . 0.0 110.851 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.3 mt -107.27 114.16 45.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.558 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.81 117.05 34.04 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.54 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.72 135.89 45.26 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.881 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -139.97 154.7 47.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.83 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 60.5 m -70.73 142.96 51.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.079 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.198 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 . . . . . 0 N--CA 1.489 1.493 0 CA-C-O 120.716 0.293 . . . . 0.0 111.045 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.0 m -126.48 156.82 40.11 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.071 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.4 t0 70.25 109.16 0.06 Allowed 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.055 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.9 t -94.91 116.37 36.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.269 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -87.25 115.42 24.63 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.735 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.7 mt -114.25 126.47 71.77 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.933 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.9 mtpt -100.65 115.45 30.24 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.873 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -101.58 138.93 37.93 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.025 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -122.44 128.17 50.55 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.962 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 25.2 t-80 -142.86 112.02 6.6 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.57 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 59.21 34.06 22.95 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.114 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.73 -31.01 6.82 Favored Glycine 0 CA--C 1.524 0.602 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.815 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -65.41 142.99 58.0 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.873 0.368 . . . . 0.0 111.151 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -119.71 143.55 47.71 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.362 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.92 134.89 30.65 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.948 179.617 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 22.1 mt -105.77 118.17 52.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.88 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.8 mt -128.33 129.9 69.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.179 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.46 147.44 23.54 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.2 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -130.38 138.8 50.56 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.287 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.5 p -94.98 119.83 34.16 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.948 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.5 mtt180 -68.61 150.32 97.7 Favored Pre-proline 0 N--CA 1.464 0.254 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.893 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -72.72 144.43 80.77 Favored 'Cis proline' 0 C--N 1.35 0.623 0 C-N-CA 123.776 -1.343 . . . . 0.0 112.425 0.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.3 p -113.2 123.61 69.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.027 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.7 mptt -101.01 137.52 39.27 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.048 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -54.78 -40.36 69.35 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.036 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -63.19 -45.31 92.34 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.973 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -64.37 -44.41 91.47 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.131 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.3 t -62.46 -46.8 95.53 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.663 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.05 -46.07 85.97 Favored 'General case' 0 CA--C 1.528 0.111 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.038 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.05 -42.07 79.87 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 120.6 0.238 . . . . 0.0 111.246 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 38.9 tttp -71.1 -49.8 40.47 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.25 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 39.6 t -64.82 -41.53 92.42 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.765 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 54.9 m -58.81 -39.43 81.14 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.905 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.4 m -71.91 -36.81 70.09 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 121.369 -0.132 . . . . 0.0 111.258 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 42.3 t -61.21 -55.18 26.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 N-CA-C 111.541 0.2 . . . . 0.0 111.541 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -89.96 -19.68 24.21 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -178.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 105.07 179.24 24.24 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.301 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -139.92 154.17 70.35 Favored Pre-proline 0 N--CA 1.464 0.271 0 O-C-N 122.819 -0.224 . . . . 0.0 110.914 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -85.84 148.73 44.04 Favored 'Cis proline' 0 C--N 1.351 0.684 0 C-N-CA 123.607 -1.414 . . . . 0.0 113.207 0.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 20.0 mt -138.74 158.59 43.95 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.03 179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -113.3 140.35 48.07 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.002 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.9 mt -102.75 107.08 17.84 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.196 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -104.03 125.65 50.55 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.128 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -114.53 130.3 56.74 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.408 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 9.4 ptp -128.62 122.16 30.28 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.853 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -79.91 -59.7 2.63 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.462 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -175.03 -55.75 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.463 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -106.8 -26.32 11.32 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.551 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.3 mt -123.36 145.68 48.55 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.715 0.293 . . . . 0.0 111.248 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 56.1 p -120.82 132.78 55.2 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.811 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mp -126.94 132.53 69.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.972 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.33 118.98 25.2 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.323 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 26.8 mt -65.89 105.73 1.38 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.945 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.0 mttp -110.88 -35.82 5.85 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.222 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -136.47 171.91 13.79 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.105 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -58.2 -29.94 66.07 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.119 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.426 ' HA ' ' OD2' ' A' ' 60' ' ' ASP . 1.2 m-20 -56.26 -43.5 78.79 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.116 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -66.89 -32.22 73.34 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.799 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 33.1 tp -64.86 -45.44 86.08 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.726 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.426 ' OD2' ' HA ' ' A' ' 57' ' ' ASP . 2.5 p30 -70.56 -31.85 69.03 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.577 0.227 . . . . 0.0 110.975 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -38.02 89.06 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.713 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.43 -42.98 86.92 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.2 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.3 mm -66.34 -41.69 89.36 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.156 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -55.15 -45.46 75.67 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.192 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.6 mt -66.57 -39.27 83.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.813 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 20.0 tp -64.56 -43.67 93.2 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.877 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -57.16 -42.68 81.55 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.069 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.71 -31.95 72.96 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.073 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 27.5 t -79.03 146.18 33.46 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.128 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.63 -18.75 62.18 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.541 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 60.3 p -93.57 38.2 1.06 Allowed 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.756 0.312 . . . . 0.0 111.554 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.35 84.71 4.51 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.639 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp -138.93 -58.99 0.6 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.929 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.1 p -112.99 168.22 9.87 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.041 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.5 mp -122.62 138.81 54.48 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.038 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 7.4 ttp180 -97.31 87.57 4.19 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.982 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.1 mt -117.68 118.2 57.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.691 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.3 tt -108.52 128.65 54.99 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.178 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.5 pp -113.76 136.61 52.67 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.846 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -135.6 148.19 48.95 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.163 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.6 p -72.65 147.39 45.81 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.391 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -78.81 3.41 16.84 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -179.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.3 t70 62.96 127.38 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.098 0.559 . . . . 0.0 112.059 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.5 mtt85 72.28 125.81 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.004 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.3 p-10 -105.97 155.8 19.01 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.557 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.3 mp -107.29 100.52 9.96 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.18 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -160.23 63.32 0.34 Allowed 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.043 0.449 . . . . 0.0 111.205 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.88 165.3 17.89 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.457 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -120.42 -69.47 0.84 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.566 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 16.7 p80 -159.6 156.84 28.68 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.962 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -161.16 155.32 22.73 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.901 0.381 . . . . 0.0 111.385 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -71.17 146.56 49.04 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.902 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.081 -0.962 . . . . 0.0 111.346 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 120.586 0.232 . . . . 0.0 111.194 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.424 ' O ' ' HA ' ' A' ' 20' ' ' SER . 1.4 m 58.3 81.49 0.15 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.174 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -171.96 94.42 0.15 Allowed 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.987 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 22.2 t -96.08 123.19 48.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.888 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.7 mtt180 -87.29 114.81 24.23 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.951 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 23.7 mt -105.9 118.51 53.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.827 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -103.65 114.7 29.16 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.363 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.494 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 0.9 OUTLIER -117.6 145.53 44.25 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.921 -179.774 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -119.21 139.88 51.12 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.615 -179.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . 0.44 ' CD2' HD13 ' A' ' 79' ' ' LEU . 24.5 t-80 -141.02 114.65 8.89 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.364 179.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 51.3 m-20 57.63 33.47 23.29 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.657 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.14 -47.0 1.14 Allowed Glycine 0 C--N 1.336 0.545 0 C-N-CA 120.863 -0.684 . . . . 0.0 113.36 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.24 145.39 51.39 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.815 0.34 . . . . 0.0 110.997 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 ptp180 -124.1 147.66 47.74 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.622 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.494 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -131.02 137.33 49.14 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.749 179.641 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 19.1 mt -117.41 126.32 74.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.908 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 28.0 mt -138.98 131.6 37.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.957 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.37 145.73 24.72 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.179 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -131.13 125.36 32.89 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.116 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.424 ' HA ' ' O ' ' A' ' 2' ' ' SER . 40.7 t -71.39 126.68 30.29 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.007 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 25.6 mtt85 -71.6 144.91 89.3 Favored Pre-proline 0 CA--C 1.53 0.192 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.031 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -77.38 123.12 9.2 Favored 'Cis proline' 0 C--N 1.349 0.581 0 C-N-CA 123.193 -1.586 . . . . 0.0 112.612 -0.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.3 p -72.27 145.4 12.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.058 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.5 mmmt -111.38 132.28 54.55 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.259 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -57.46 -43.29 83.88 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.895 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -59.19 -43.56 92.21 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.167 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.7 -44.57 85.74 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.346 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 23.7 t -65.39 -47.97 84.9 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.738 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.67 -46.14 86.92 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.345 179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 67.2 t60 -56.38 -41.01 75.51 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.535 0.207 . . . . 0.0 111.443 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.4 tttp -71.05 -49.79 40.97 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.341 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 46.5 t -66.4 -43.01 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.602 -179.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 53.4 m -59.05 -39.24 81.42 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.314 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.5 m -72.2 -36.69 69.26 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.399 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.0 t -62.34 -51.6 70.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -95.59 -18.09 20.85 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -178.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 105.93 -177.51 22.58 Favored Glycine 0 CA--C 1.523 0.557 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.599 -179.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.433 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 7.6 pm0 -134.08 155.43 80.07 Favored Pre-proline 0 N--CA 1.463 0.219 0 O-C-N 122.776 -0.249 . . . . 0.0 111.098 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.433 ' HA ' ' HB2' ' A' ' 38' ' ' GLN . 83.4 Cg_endo -90.0 145.1 17.82 Favored 'Cis proline' 0 C--N 1.348 0.508 0 C-N-CA 123.651 -1.396 . . . . 0.0 113.101 0.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 23.2 mt -138.49 139.87 38.96 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.831 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -112.4 140.28 47.27 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.092 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mt -87.45 113.97 23.63 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.036 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -106.04 117.54 34.28 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.014 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 14.2 t80 -107.17 122.84 47.31 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 120.783 0.325 . . . . 0.0 110.697 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 28.2 mtp -110.62 128.17 55.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.431 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -71.3 -56.42 6.05 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.711 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -178.86 -52.99 0.01 OUTLIER 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.329 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -104.73 -29.73 10.38 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.53 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -119.68 160.35 22.69 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.876 0.37 . . . . 0.0 111.522 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.5 m -104.64 132.33 51.02 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.988 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 25.1 mm -116.02 133.45 62.44 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.916 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.0 mt -104.4 125.15 50.35 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.89 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -119.59 106.13 11.88 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.398 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -107.77 -34.43 6.97 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.137 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -98.23 166.11 11.56 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.626 0.25 . . . . 0.0 110.825 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.06 -35.64 80.93 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.04 179.428 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -52.84 -47.05 68.02 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.141 179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.4 -31.66 72.56 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.177 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.0 tp -72.69 -39.03 67.34 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.68 -0.236 . . . . 0.0 110.552 179.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.86 -43.5 98.71 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.268 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -66.63 -38.84 87.77 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.818 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.31 -45.0 93.38 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.562 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 14.1 mt -66.37 -41.13 88.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.894 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -55.08 -44.96 75.33 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.039 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.3 mt -64.82 -43.11 96.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.733 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 9.2 tp -62.01 -47.3 85.39 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.129 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.97 -37.49 87.84 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.246 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -72.61 -35.27 67.82 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.069 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.0 t -76.39 128.26 34.47 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.39 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 27.9 p -75.09 -38.43 61.22 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.826 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.74 -47.16 32.74 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.171 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -78.79 91.76 4.76 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.113 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.9 mtpt -97.0 -45.81 6.44 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.184 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.8 p -91.0 151.2 21.15 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.902 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.98 124.15 35.87 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.01 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -93.68 88.9 6.0 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.878 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 31.1 mt -111.93 117.66 55.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.583 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.9 tp -102.06 123.69 46.37 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.852 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.44 HD13 ' CD2' ' A' ' 10' ' ' HIS . 2.3 pp -112.07 130.99 55.7 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.778 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.5 142.69 50.01 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.988 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.51 143.79 27.55 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.859 179.299 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.59 5.05 47.36 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.971 -0.558 . . . . 0.0 112.1 179.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 61.33 173.72 0.11 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.82 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -119.12 91.18 3.49 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.173 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -90.66 -174.73 4.18 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.038 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.78 62.31 7.38 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 120.854 0.359 . . . . 0.0 111.42 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -151.86 25.68 0.65 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.409 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 12.5 m80 -115.67 -23.98 8.46 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.58 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 65.55 74.62 0.37 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.786 0.327 . . . . 0.0 111.099 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -137.56 -72.58 0.42 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.511 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -177.19 177.35 1.24 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.841 0.353 . . . . 0.0 110.907 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -148.84 -55.69 0.2 Allowed 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.74 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 14.3 p80 . . . . . 0 C--O 1.251 1.149 0 CA-C-O 118.355 -0.831 . . . . 0.0 111.216 179.833 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 120.811 0.339 . . . . 0.0 111.125 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.3 m -151.72 99.57 2.6 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.153 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -170.1 89.83 0.17 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.162 0.506 . . . . 0.0 111.359 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 23.1 t -90.42 116.38 31.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.926 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.6 mtt180 -90.06 121.79 32.46 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.744 0.307 . . . . 0.0 111.049 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.422 HG21 ' CZ ' ' A' ' 8' ' ' PHE . 2.6 mt -115.57 130.06 70.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.989 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.4 tttm -95.45 126.89 41.06 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.699 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.422 ' CZ ' HG21 ' A' ' 6' ' ' ILE . 81.5 m-85 -117.1 136.25 53.14 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.282 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -121.96 127.54 50.47 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.074 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.6 t-80 -131.13 112.57 12.98 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.686 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 55.67 34.76 23.92 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.523 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 98.69 -35.42 4.64 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.686 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.79 136.58 57.07 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.716 0.293 . . . . 0.0 110.817 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.13 145.29 41.19 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.621 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.63 130.2 13.97 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.087 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.9 mp -102.49 125.8 56.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.808 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.6 mt -130.38 134.29 62.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.219 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.27 138.8 31.22 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.248 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 -130.78 117.4 19.32 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.76 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.1 m -76.85 143.34 39.77 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.728 0.299 . . . . 0.0 111.188 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.5 mtm105 -96.05 154.98 38.75 Favored Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.125 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -73.12 142.44 74.76 Favored 'Cis proline' 0 C--N 1.349 0.597 0 C-N-CA 123.57 -1.429 . . . . 0.0 112.335 -0.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.5 p -128.41 147.58 32.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.944 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.97 143.96 44.73 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.007 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -56.52 -36.95 69.8 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.285 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.87 -44.93 91.19 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.9 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -69.63 -44.3 70.9 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.007 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.52 -46.16 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.866 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -58.65 -42.19 87.81 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.286 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -57.42 -46.1 83.88 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.742 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.5 tttp -70.18 -48.78 55.77 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.943 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 44.4 t -58.81 -42.37 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-N 116.76 -0.2 . . . . 0.0 111.318 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 86.4 m -64.19 -39.58 94.3 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.056 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 60.1 m -72.47 -42.72 64.63 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.449 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.5 t -61.98 -51.37 73.34 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -87.81 -20.95 25.39 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 103.49 -175.72 23.76 Favored Glycine 0 C--N 1.337 0.631 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.676 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -144.32 155.46 57.73 Favored Pre-proline 0 N--CA 1.465 0.316 0 CA-C-O 120.528 0.204 . . . . 0.0 111.01 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -84.09 137.63 28.16 Favored 'Cis proline' 0 C--N 1.35 0.641 0 C-N-CA 123.546 -1.439 . . . . 0.0 113.205 0.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.8 mt -137.18 130.41 31.02 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.744 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -105.09 139.86 39.13 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.729 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 64.7 mt -92.16 108.53 20.01 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.808 0.337 . . . . 0.0 110.94 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -109.36 117.74 34.83 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.495 -179.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -96.1 124.52 40.14 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.392 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 53.4 mtp -117.56 125.87 51.57 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.542 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.1 t30 -87.48 -52.61 5.26 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.777 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -173.58 -62.55 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.369 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -108.82 -25.55 10.73 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.565 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -111.93 149.33 32.07 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.823 0.344 . . . . 0.0 111.147 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.6 m -113.22 131.15 56.01 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.978 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.8 mt -121.63 133.99 66.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.909 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.9 mp -105.34 124.65 49.9 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.709 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.2 mp -91.81 92.61 8.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.721 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 42.8 mttm -111.17 30.44 6.9 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.134 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -175.97 167.39 3.02 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.912 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -63.13 -38.95 93.22 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.311 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.36 -44.45 80.14 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.338 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -64.78 -46.16 83.27 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.001 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 33.0 tp -61.26 -41.25 96.58 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.664 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -61.17 -43.09 99.43 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.575 179.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.3 mttm -65.31 -38.67 90.92 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.011 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.54 -41.35 98.82 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.015 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 18.8 mt -64.9 -43.84 96.25 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.081 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.662 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.67 -45.06 73.83 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.206 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 41.5 mt -68.36 -45.24 82.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.353 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -65.92 -48.05 72.7 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.041 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -60.2 -41.77 93.67 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.296 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -74.15 -31.65 62.81 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.66 -179.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 76.9 p -80.91 112.07 17.96 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.6 0.238 . . . . 0.0 110.663 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 53.0 m -71.43 -30.32 65.91 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.062 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.16 -34.09 71.68 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.587 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 5.9 ttm -111.61 140.97 45.79 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.649 0.261 . . . . 0.0 111.053 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.4 mttt -115.46 -44.36 2.98 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.118 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 67.5 m -100.46 170.98 8.03 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.745 179.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -91.87 120.6 32.71 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.786 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.0 mmt85 -91.76 73.98 5.78 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.537 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 36.0 mt -111.34 124.71 68.37 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.833 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.9 tp -102.08 119.63 39.11 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.863 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.0 pp -106.86 125.07 50.53 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.888 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -116.8 162.75 17.21 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.282 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 40.6 t -88.21 137.4 32.36 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.993 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 10.8 tp60 -87.39 5.7 37.41 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.687 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -85.03 179.58 7.25 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.912 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -116.29 34.39 5.04 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.265 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -97.78 87.23 3.97 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.947 0.404 . . . . 0.0 111.057 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.9 tt -153.57 90.25 1.39 Allowed 'General case' 0 C--O 1.235 0.337 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.037 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -142.99 91.78 2.33 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.861 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.4 m-70 -126.8 -49.53 1.49 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.237 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -172.31 -37.98 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.351 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 23.9 m170 -51.99 100.67 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 120.807 0.337 . . . . 0.0 111.008 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -155.37 -59.02 0.1 Allowed 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.773 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 62.93 -175.24 0.15 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.499 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 . . . . . 0 C--O 1.251 1.155 0 CA-C-O 118.535 -0.745 . . . . 0.0 111.366 179.974 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.507 0 CA-C-O 120.669 0.271 . . . . 0.0 111.211 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.5 p -124.6 145.02 49.84 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.12 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 69.86 114.04 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.205 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.8 t -86.06 110.48 19.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.982 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.26 108.8 19.11 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.688 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 19.5 mt -109.54 128.45 65.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.837 0.351 . . . . 0.0 111.44 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -101.35 123.4 45.38 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.828 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -115.03 139.88 49.51 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.041 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -124.26 125.44 44.39 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.959 0.409 . . . . 0.0 111.102 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.4 t-80 -138.25 124.02 19.89 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.513 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 57.64 32.07 21.31 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.29 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.36 -41.38 2.59 Favored Glycine 0 C--N 1.337 0.607 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.816 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -68.87 152.25 45.54 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 120.778 0.323 . . . . 0.0 111.332 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.15 151.43 35.67 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.186 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.3 mtt85 -128.5 127.51 42.56 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.736 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.8 mt -98.18 117.02 42.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.747 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 25.5 mm -131.2 133.42 62.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-O 120.826 0.346 . . . . 0.0 111.068 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -107.41 136.88 46.47 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.047 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.425 ' CZ ' ' HA ' ' A' ' 28' ' ' VAL . 8.5 m-85 -121.24 126.93 50.81 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.5 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -82.33 150.13 27.37 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.98 179.356 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.8 mtt-85 -87.63 143.11 33.35 Favored Pre-proline 0 N--CA 1.463 0.192 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.87 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -78.92 166.54 79.06 Favored 'Cis proline' 0 C--N 1.352 0.753 0 C-N-CA 123.661 -1.391 . . . . 0.0 112.766 0.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.5 p -146.85 139.49 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.099 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -114.65 159.79 20.07 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.681 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -55.53 -40.62 72.06 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.666 -0.243 . . . . 0.0 110.958 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.12 -43.43 91.94 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.009 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -63.02 -44.64 95.37 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.987 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.425 ' HA ' ' CZ ' ' A' ' 19' ' ' PHE . 41.1 t -68.0 -47.7 77.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.907 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -64.01 -44.91 91.16 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.172 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -56.4 -43.45 79.33 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.421 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.35 -49.33 56.62 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.096 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 47.6 t -63.13 -44.84 99.64 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.511 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 90.4 m -58.42 -39.37 79.58 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.982 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 28.5 m -72.27 -40.8 67.37 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 121.186 -0.206 . . . . 0.0 111.303 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.9 t -56.83 -51.85 62.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 120.558 0.218 . . . . 0.0 111.553 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -90.37 -27.4 19.38 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 102.44 -160.12 17.5 Favored Glycine 0 C--N 1.336 0.536 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.577 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -144.88 158.46 52.71 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 120.446 0.165 . . . . 0.0 110.868 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -87.5 131.77 12.07 Favored 'Cis proline' 0 C--N 1.346 0.427 0 C-N-CA 123.649 -1.396 . . . . 0.0 113.055 0.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 17.9 mt -136.71 147.71 46.92 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.089 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -114.55 130.17 56.73 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.991 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mt -87.8 110.07 20.21 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.873 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.429 ' CD2' ' HB3' ' A' ' 50' ' ' SER . 0.1 OUTLIER -115.41 119.46 36.32 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.495 -179.67 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.408 ' CD1' ' HB1' ' A' ' 62' ' ' ALA . 12.7 t80 -98.59 130.44 45.13 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.867 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -101.95 131.02 48.59 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.642 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -77.99 -40.12 40.17 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.786 0.327 . . . . 0.0 110.797 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -174.48 -54.51 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.202 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.8 -41.08 3.85 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.353 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -100.36 165.94 11.21 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.995 0.426 . . . . 0.0 111.388 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.429 ' HB3' ' CD2' ' A' ' 43' ' ' HIS . 2.5 m -121.29 122.25 39.49 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.763 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.15 131.78 65.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.184 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.11 135.07 34.55 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.709 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.42 86.64 3.66 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.456 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -99.55 24.57 8.04 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.672 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -166.08 160.05 16.01 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.588 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.8 -40.82 89.64 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.73 0.3 . . . . 0.0 110.394 179.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -61.94 -46.25 90.11 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.984 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -60.67 -44.33 96.6 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.882 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.7 tp -63.01 -42.96 99.97 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.111 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -69.45 -34.84 74.99 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.277 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.0 ttpt -62.39 -37.01 84.09 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.863 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.408 ' HB1' ' CD1' ' A' ' 44' ' ' TYR . . . -64.77 -37.86 89.05 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.991 179.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 33.2 mm -63.75 -43.92 98.14 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.19 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -53.9 -36.48 62.76 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.053 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.8 mt -66.63 -40.11 85.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.819 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 26.2 tp -62.39 -40.06 95.26 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.118 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.19 -34.36 68.43 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.3 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.0 -34.51 76.64 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.898 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.4 t -81.61 97.93 8.1 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.048 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.3 p -63.69 -33.76 76.36 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.404 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.8 p -71.16 -49.31 45.25 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.246 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.9 ttm -67.89 147.21 52.81 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.075 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.28 -48.34 0.59 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.31 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.41 171.11 15.57 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.706 0.289 . . . . 0.0 110.842 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -102.36 118.25 36.48 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.744 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -92.16 84.04 5.19 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.777 0.322 . . . . 0.0 110.93 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.9 mt -109.29 128.56 65.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.004 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.36 123.8 50.96 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.32 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.8 pp -112.97 131.48 55.74 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.696 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 mp -121.09 151.22 40.1 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.241 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.5 t -98.14 147.41 24.6 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.119 179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.93 5.82 44.71 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.651 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -89.04 89.4 7.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.962 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 18.2 mtp180 66.11 104.41 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.355 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 32.2 t30 -129.19 155.85 44.86 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.217 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.1 tp -112.97 166.12 11.7 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.915 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -66.81 -67.94 0.41 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.861 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -175.53 114.64 0.14 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.915 0.388 . . . . 0.0 111.094 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -148.16 155.8 41.84 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.164 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 60.3 30.88 20.2 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.061 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 6.8 t-160 -142.82 77.54 1.58 Allowed 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.49 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 33.8 m80 -126.69 136.96 53.16 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.04 -179.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 16.1 t-80 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.435 -0.793 . . . . 0.0 111.088 -179.881 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 120.902 0.382 . . . . 0.0 111.366 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.38 79.24 5.62 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.122 0.487 . . . . 0.0 110.927 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -95.61 100.95 12.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.205 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 32.2 t -75.77 129.63 36.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.973 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -87.81 112.06 22.05 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.78 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 19.8 mt -99.11 125.9 52.49 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.02 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.0 mttt -99.33 117.67 34.28 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.8 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.423 ' CD1' HD11 ' A' ' 17' ' ' ILE . 80.0 m-85 -107.37 145.72 32.52 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.036 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -125.9 126.1 43.87 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.13 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.0 t-160 -141.27 116.94 10.31 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.567 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 16.0 m120 57.21 34.92 25.52 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.236 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.94 -38.34 3.17 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.864 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -65.3 150.81 47.62 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.759 0.314 . . . . 0.0 111.291 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.58 157.14 37.88 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.357 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.2 142.28 24.92 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.056 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.3 mp -114.59 119.56 61.87 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.941 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.423 HD11 ' CD1' ' A' ' 8' ' ' PHE . 3.1 mt -127.12 130.79 71.16 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.038 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.11 143.42 26.38 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.434 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -137.6 117.08 12.86 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.903 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.9 p -72.69 143.21 48.16 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.083 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.82 153.92 37.65 Favored Pre-proline 0 C--O 1.232 0.171 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.305 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -74.53 140.57 68.02 Favored 'Cis proline' 0 C--N 1.351 0.706 0 C-N-CA 123.54 -1.442 . . . . 0.0 112.528 0.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.9 p -127.01 143.67 39.71 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.048 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.64 142.48 27.3 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.062 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 50.3 t80 -59.58 -36.99 77.31 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.209 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.56 -45.0 89.89 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.995 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -63.05 -44.58 95.48 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.157 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 24.9 t -67.05 -46.7 84.0 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.935 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -45.2 89.81 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.169 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -56.78 -46.77 81.29 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.761 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.06 -49.83 63.81 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.3 179.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 47.4 t -58.48 -43.29 86.52 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.335 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 95.4 m -62.8 -39.45 94.3 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.02 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 39.0 m -72.08 -42.86 65.68 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 121.254 -0.178 . . . . 0.0 111.425 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.7 t -56.57 -51.91 59.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-O 120.54 0.21 . . . . 0.0 111.533 -179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -88.32 -28.21 21.18 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.73 -159.95 18.17 Favored Glycine 0 C--N 1.334 0.442 0 C-N-CA 121.0 -0.619 . . . . 0.0 112.347 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.76 156.15 55.98 Favored Pre-proline 0 N--CA 1.464 0.244 0 CA-C-O 120.437 0.16 . . . . 0.0 110.787 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -88.07 131.35 10.97 Favored 'Cis proline' 0 C--N 1.35 0.639 0 C-N-CA 123.559 -1.434 . . . . 0.0 112.939 0.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.4 mt -138.34 130.55 28.7 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.138 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -101.64 135.2 43.56 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.019 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.3 mt -91.27 104.16 16.74 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.781 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -106.48 129.71 54.4 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.27 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -106.1 119.32 38.91 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.582 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 5.3 mtt -131.76 140.01 49.11 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.933 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 -99.35 -45.98 5.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.775 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -172.95 -64.11 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.486 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -108.82 -30.83 7.95 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.464 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.3 mt -93.73 132.58 37.95 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.716 0.293 . . . . 0.0 111.227 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 94.8 p -112.1 122.58 48.15 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.798 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.0 mp -127.5 132.72 69.01 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.032 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.9 tt -102.96 131.17 50.11 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.515 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 12.1 mt -74.52 84.75 2.03 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.085 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.2 tptt -77.86 -37.61 47.89 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.977 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -145.23 -179.24 6.51 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.139 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -57.47 -35.09 69.71 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.842 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.24 -46.18 79.69 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.963 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -60.45 -41.61 94.44 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.711 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.7 tp -63.42 -43.45 97.45 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.125 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.46 -41.11 98.52 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.254 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.04 -35.75 81.27 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.684 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.96 -38.34 90.71 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.166 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.6 mm -63.89 -42.43 95.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.083 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -56.71 -39.46 73.91 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.035 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 47.6 mt -68.36 -40.48 82.47 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.046 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 92.8 mt -61.05 -46.9 88.82 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.061 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.91 -31.34 70.86 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.176 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.7 mmt180 -66.94 -28.02 67.94 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.257 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.8 t -59.75 148.49 34.08 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.872 0.367 . . . . 0.0 111.502 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.07 -35.52 71.93 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.234 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -158.36 93.25 1.2 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.996 0.427 . . . . 0.0 111.754 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -167.22 107.83 0.61 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.053 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -99.28 -31.89 11.47 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.341 179.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.87 165.03 25.7 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.744 0.307 . . . . 0.0 111.372 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -110.27 131.66 54.86 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.281 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.18 78.95 8.74 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.936 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.7 mm -104.01 113.58 41.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.607 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.4 tt -110.77 117.15 32.66 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.861 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.5 pp -112.33 130.61 55.9 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.874 0.368 . . . . 0.0 110.967 179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -121.64 156.94 31.93 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.204 -179.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 6.1 t -83.01 147.65 28.04 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.779 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 33.2 tp60 -84.55 5.96 25.65 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.915 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -89.66 117.98 28.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.193 -179.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 67.73 100.16 0.05 Allowed 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.348 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -142.26 75.38 1.49 Allowed 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.021 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 55.91 73.53 0.43 Allowed 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.088 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -157.43 -50.27 0.07 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.357 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -82.88 141.5 32.18 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.044 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 23.3 m80 62.5 75.99 0.38 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.198 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 12.3 t-160 -138.73 101.1 4.24 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.947 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -126.15 120.31 29.79 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.437 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 21.9 p80 -105.36 133.52 49.98 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.266 -179.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.094 -0.955 . . . . 0.0 111.537 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 120.786 0.327 . . . . 0.0 111.091 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m -117.53 160.0 21.95 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.638 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 60.87 80.21 0.22 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.896 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 25.4 t -86.18 145.04 8.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.424 -179.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -93.49 106.41 18.38 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.017 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.2 mt -104.69 125.96 59.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.071 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -103.93 129.47 51.48 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.596 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -111.83 131.55 55.27 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.859 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.426 ' HG3' ' HG3' ' A' ' 14' ' ' ARG . 24.7 tt0 -119.39 130.01 55.09 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.819 0.342 . . . . 0.0 111.116 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.7 t-160 -141.07 121.0 13.59 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.694 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 61.07 26.2 16.16 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.604 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.36 -46.96 1.14 Allowed Glycine 0 C--N 1.338 0.644 0 C-N-CA 120.912 -0.661 . . . . 0.0 113.415 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -66.02 139.58 58.22 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.925 0.362 . . . . 0.0 111.275 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.426 ' HG3' ' HG3' ' A' ' 9' ' ' GLU . 2.6 mtt85 -108.91 155.25 21.05 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.419 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.1 149.22 50.0 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.926 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 34.3 mt -115.32 117.68 56.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.078 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 21.2 mm -131.57 136.49 57.17 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.257 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.53 141.32 28.74 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.992 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -128.91 117.1 20.43 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.937 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 37.8 t -86.29 140.84 29.71 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.89 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -84.79 157.53 60.46 Favored Pre-proline 0 CA--C 1.531 0.25 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.025 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.75 157.48 99.52 Favored 'Cis proline' 0 C--N 1.35 0.628 0 C-N-CA 123.486 -1.464 . . . . 0.0 112.77 0.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.7 p -139.25 139.25 39.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.196 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.3 mptt -119.47 154.61 33.5 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.719 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -54.35 -45.13 72.65 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.85 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.43 -41.94 99.09 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.16 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -62.58 -44.24 96.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.987 -179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.4 t -67.7 -43.25 86.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.793 179.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.81 -45.37 86.2 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.442 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.74 -42.75 99.38 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.315 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -69.92 -49.72 49.24 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.267 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 47.6 t -61.55 -40.91 88.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 CA-C-N 116.663 -0.244 . . . . 0.0 111.476 -179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 22.3 m -58.62 -41.26 85.49 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.088 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 34.8 m -72.56 -37.39 68.24 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 111.524 0.194 . . . . 0.0 111.524 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.1 t -61.23 -52.7 58.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 N-CA-C 111.876 0.325 . . . . 0.0 111.876 -179.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -98.16 -15.85 19.75 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -178.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.14 -156.9 21.88 Favored Glycine 0 C--N 1.334 0.457 0 C-N-CA 120.598 -0.81 . . . . 0.0 112.349 -179.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -144.74 158.48 53.14 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.456 0.169 . . . . 0.0 111.056 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -89.61 132.48 9.74 Favored 'Cis proline' 0 C--N 1.349 0.595 0 C-N-CA 123.771 -1.345 . . . . 0.0 112.889 0.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 29.2 mt -138.53 135.45 35.08 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.012 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -114.73 139.52 49.62 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.049 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.7 mt -80.81 108.89 14.86 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.945 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.8 m80 -114.0 120.42 40.58 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.116 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.454 ' CE2' HG12 ' A' ' 77' ' ' ILE . 0.5 OUTLIER -88.88 129.53 35.58 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.854 179.721 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 17.6 mtp -125.8 117.8 24.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.53 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 20.0 m-20 -79.18 -54.25 6.17 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.794 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -172.9 -61.34 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.353 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -107.46 -24.76 11.7 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.434 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.59 149.84 29.82 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.865 0.364 . . . . 0.0 111.389 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.53 122.36 45.46 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.001 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.4 HG22 HD11 ' A' ' 51' ' ' ILE . 28.7 mm -114.37 131.36 66.62 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.785 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.7 tt -94.78 130.52 41.29 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.783 0.325 . . . . 0.0 111.024 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -81.79 95.32 7.25 Favored 'General case' 0 CA--C 1.527 0.086 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.379 179.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -84.71 -36.03 22.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.122 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.1 m-20 -144.67 -179.73 6.76 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.936 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 13.3 tp60 -58.41 -33.41 69.63 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.8 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -53.16 -41.65 65.38 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.201 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -64.53 -40.96 96.57 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.769 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 11.0 mt -65.52 -42.0 92.53 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.008 179.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -60.93 -39.81 90.83 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.91 -179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -68.24 -39.48 82.27 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.642 178.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.65 -43.67 88.68 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.558 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.2 mt -62.81 -40.97 90.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 116.701 -0.227 . . . . 0.0 110.771 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -52.86 -34.97 56.8 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.24 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 30.6 mm -66.65 -45.37 88.54 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.07 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.0 mt -66.77 -45.14 79.46 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.988 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.12 -40.16 94.96 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.004 179.744 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -63.21 -35.23 79.63 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.129 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.8 t -70.48 122.14 19.1 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.899 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.74 -36.01 75.73 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.222 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 32.3 p -70.64 -81.06 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.907 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.3 tmm? 64.04 160.01 0.1 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.064 0.459 . . . . 0.0 111.696 179.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.34 -59.72 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.367 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 m -155.52 174.77 14.79 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.574 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.4 mp -91.95 131.66 37.1 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.413 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -95.7 74.78 3.18 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.136 0.493 . . . . 0.0 111.199 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.454 HG12 ' CE2' ' A' ' 44' ' ' TYR . 25.6 mt -103.92 129.22 56.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.819 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.9 tt -113.38 118.25 34.03 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.103 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.3 pp -104.19 131.55 51.37 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.706 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.4 pp -118.8 159.72 23.21 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.067 0.46 . . . . 0.0 111.334 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -90.72 147.6 23.15 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.77 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 -77.93 5.46 9.69 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -83.86 -167.05 1.58 Allowed 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.511 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 10.6 mtt85 -128.63 104.05 7.44 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.698 0.285 . . . . 0.0 111.215 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.4 p-10 -114.85 34.15 4.98 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.143 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -89.24 159.64 17.33 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.049 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -144.15 163.18 34.35 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.274 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 69.1 m80 -139.72 117.76 11.83 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.174 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 41.7 m80 -141.21 34.98 1.7 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.248 179.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -141.69 163.75 32.08 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.03 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 8.9 m80 -97.81 32.73 2.26 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.208 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -154.66 34.35 0.4 Allowed 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.012 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 1.4 t60 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.098 -0.953 . . . . 0.0 110.973 179.969 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 . . . . . 0 N--CA 1.491 1.579 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 m 63.03 72.44 0.49 Allowed 'General case' 0 CA--C 1.529 0.143 0 CA-C-O 121.128 0.489 . . . . 0.0 111.028 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -167.04 82.24 0.23 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.302 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 36.2 t -79.86 125.14 38.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.868 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.3 mtm105 -94.36 106.34 18.32 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.699 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.7 mp -101.92 134.43 42.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.997 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.8 mttm -100.34 118.09 35.89 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.714 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.449 ' CD1' HD11 ' A' ' 17' ' ' ILE . 93.2 m-85 -107.39 131.88 53.78 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.146 -179.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -126.58 131.94 51.41 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.212 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 9.0 t-160 -139.49 121.08 15.2 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.529 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.0 m-20 57.25 31.64 20.41 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.221 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.11 -30.22 7.87 Favored Glycine 0 CA--C 1.524 0.609 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.937 -179.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -65.61 140.57 58.53 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.761 0.315 . . . . 0.0 111.187 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -103.69 154.97 18.95 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.32 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.2 tpp180 -151.76 144.23 24.15 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.069 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.3 mt -113.66 127.64 70.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.001 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.449 HD11 ' CD1' ' A' ' 8' ' ' PHE . 20.1 mt -138.39 125.61 27.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-O 120.784 0.326 . . . . 0.0 111.29 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -112.49 131.07 55.77 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.042 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -128.07 126.8 41.93 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.75 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.3 t -68.3 128.11 35.38 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.946 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.6 mtm180 -71.35 150.83 94.21 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.062 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -74.62 125.76 11.62 Favored 'Cis proline' 0 C--N 1.35 0.645 0 C-N-CA 123.517 -1.451 . . . . 0.0 112.308 0.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.5 p -73.58 131.91 34.19 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.04 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.98 127.14 42.66 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.154 -179.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -53.95 -43.72 70.1 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.076 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -60.97 -38.85 87.38 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.087 179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -69.17 -44.27 72.58 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.124 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.0 t -63.76 -47.24 91.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.019 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -63.91 -36.75 84.96 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.186 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -56.68 -45.22 81.87 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.583 0.23 . . . . 0.0 111.061 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.89 -48.84 62.36 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.325 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 50.0 t -62.63 -40.58 88.92 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.538 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 79.9 m -61.01 -47.26 87.27 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.896 -0.138 . . . . 0.0 111.269 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.0 m -72.88 -44.52 61.21 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 70.1 t -67.1 -44.8 87.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.449 ' HB2' HD12 ' A' ' 40' ' ' LEU . 15.9 m-85 -100.28 7.06 44.65 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.09 172.7 23.59 Favored Glycine 0 C--N 1.339 0.704 0 C-N-CA 120.503 -0.856 . . . . 0.0 112.88 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -135.04 154.65 79.23 Favored Pre-proline 0 C--O 1.234 0.242 0 O-C-N 122.853 -0.204 . . . . 0.0 110.98 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -88.02 153.61 38.33 Favored 'Cis proline' 0 C--N 1.35 0.609 0 C-N-CA 123.567 -1.43 . . . . 0.0 113.338 0.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.449 HD12 ' HB2' ' A' ' 36' ' ' PHE . 15.7 mt -124.6 160.4 28.51 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.08 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -111.46 126.3 54.8 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.661 179.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.2 mp -90.23 96.24 10.57 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.818 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -115.22 122.98 47.66 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.284 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -105.79 129.4 53.99 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.691 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -131.27 120.73 23.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.731 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -85.02 -68.42 0.73 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.851 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -149.08 -74.61 0.17 Allowed 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.393 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -110.1 4.66 21.4 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.433 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -130.12 140.03 50.84 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.792 0.329 . . . . 0.0 111.277 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -115.23 128.3 56.06 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.712 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 18.8 mt -128.39 134.26 65.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.958 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 39.8 mt -93.85 132.81 37.9 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.941 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -122.95 88.04 2.86 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.011 0.434 . . . . 0.0 111.26 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.92 -32.51 14.54 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.969 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -100.87 166.64 10.74 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.982 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -31.98 73.44 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.027 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -56.82 -50.11 73.35 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.063 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -63.09 -45.02 94.1 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.822 0.344 . . . . 0.0 110.802 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.3 tp -58.59 -45.88 88.16 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.022 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.79 -42.18 97.79 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.012 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.8 tmtt? -62.34 -38.63 90.21 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.729 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.42 -39.88 94.75 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.54 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 12.7 mt -63.57 -43.73 98.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-O 120.606 0.241 . . . . 0.0 110.881 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -56.17 -39.5 72.43 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.11 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.4 mt -64.03 -45.03 97.83 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.907 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.5 tt -61.85 -47.35 85.45 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.673 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -58.6 -40.31 82.89 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.076 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -33.14 74.02 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.384 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 33.6 t -83.2 119.97 25.22 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.754 0.311 . . . . 0.0 111.208 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.4 p -68.0 -35.37 78.21 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.921 179.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.99 -37.08 67.13 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.402 -179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.89 109.0 15.03 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.711 0.291 . . . . 0.0 111.132 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.77 -31.99 7.24 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.784 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.2 m -122.15 154.35 37.54 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.656 0.265 . . . . 0.0 110.948 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.1 mp -92.74 117.35 29.91 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.174 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.74 86.1 3.99 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.384 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.9 mt -102.26 131.79 49.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.681 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 41.8 tp -102.12 117.25 34.38 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.755 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.4 HD11 HD22 ' A' ' 40' ' ' LEU . 2.7 pp -104.87 126.95 52.48 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.865 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.8 mp -119.2 122.74 42.67 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.849 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.75 142.84 44.3 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.153 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -85.39 5.63 30.05 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.904 179.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -138.98 167.39 22.15 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.954 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 4.7 mtt-85 -106.53 -34.91 7.23 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.255 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -98.14 142.43 29.84 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.799 0.333 . . . . 0.0 110.941 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.3 mt -102.59 138.37 39.59 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.179 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -119.53 166.04 13.63 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.198 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 19.6 t60 63.72 87.09 0.11 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.447 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 5.2 m170 -133.22 115.34 14.88 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.046 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 8.4 m170 -101.63 -66.42 0.92 Allowed 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.783 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -138.4 146.71 42.54 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.807 0.337 . . . . 0.0 111.05 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -139.78 169.21 18.14 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.387 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.554 -0.736 . . . . 0.0 111.135 179.821 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.428 0 CA-C-O 121.096 0.474 . . . . 0.0 111.162 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.4 m 57.82 72.54 0.51 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.191 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -158.5 155.92 29.32 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.403 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.415 ' CG1' HD21 ' A' ' 75' ' ' LEU . 17.6 t -150.09 128.26 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.993 179.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -97.09 116.27 29.0 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.637 0.256 . . . . 0.0 110.963 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 21.7 mt -107.52 118.16 54.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.183 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.471 ' CD ' ' HB3' ' A' ' 74' ' ' SER . 0.0 OUTLIER -95.03 109.59 21.61 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.71 179.786 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.449 ' CD1' HD22 ' A' ' 79' ' ' LEU . 16.2 m-85 -104.28 142.25 34.86 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.154 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -134.47 124.24 25.28 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.886 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . 0.413 ' HB2' HD13 ' A' ' 79' ' ' LEU . 10.9 t-160 -142.28 121.21 12.8 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.699 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 62.1 t30 57.16 34.0 24.18 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.88 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 91.02 -32.23 5.25 Favored Glycine 0 C--N 1.337 0.622 0 C-N-CA 121.047 -0.596 . . . . 0.0 113.075 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.35 136.86 55.47 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.836 0.35 . . . . 0.0 111.247 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -114.19 142.6 46.04 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.946 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.8 mtm-85 -134.11 140.49 46.63 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.172 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.9 mm -114.1 117.44 55.52 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.003 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.1 mt -125.78 137.89 56.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.215 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -110.54 133.94 52.84 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.172 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -125.4 122.83 37.86 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.196 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.88 158.49 19.31 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.042 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.05 154.95 40.58 Favored Pre-proline 0 CA--C 1.531 0.245 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.955 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -76.7 126.6 13.55 Favored 'Cis proline' 0 C--N 1.351 0.71 0 C-N-CA 123.396 -1.502 . . . . 0.0 112.737 -0.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.5 p -90.07 146.82 5.72 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.335 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.5 mtpt -120.82 143.66 48.75 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.098 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 24.3 t80 -54.79 -52.97 60.98 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.077 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.42 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 0.3 OUTLIER -61.1 -34.82 75.55 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.163 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.33 -43.54 77.29 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.139 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 43.5 t -63.18 -47.63 91.44 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.126 0 CA-C-N 116.693 -0.231 . . . . 0.0 111.146 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.42 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 9.3 pt-20 -64.49 -37.9 89.13 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.276 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -49.03 76.55 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.722 -0.217 . . . . 0.0 110.892 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.74 -48.96 64.98 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.278 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 43.0 t -59.17 -41.44 83.73 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 116.678 -0.237 . . . . 0.0 111.358 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 99.4 m -65.01 -41.45 95.32 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.908 -0.133 . . . . 0.0 111.042 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.9 m -72.76 -43.71 62.53 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 121.108 -0.237 . . . . 0.0 111.617 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.5 t -66.47 -49.67 73.41 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 N-CA-C 111.574 0.213 . . . . 0.0 111.574 -179.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -88.71 -10.72 47.41 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -179.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 91.21 -176.89 40.8 Favored Glycine 0 C--N 1.338 0.65 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.575 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.439 ' HA ' HD13 ' A' ' 40' ' ' LEU . 1.0 OUTLIER -145.19 156.31 54.35 Favored Pre-proline 0 N--CA 1.465 0.285 0 CA-C-O 120.528 0.204 . . . . 0.0 110.83 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -93.25 128.22 5.12 Favored 'Cis proline' 0 C--N 1.351 0.699 0 C-N-CA 123.918 -1.284 . . . . 0.0 112.933 0.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 38' ' ' GLN . 6.3 mp -134.57 139.98 45.78 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.992 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.66 139.47 38.2 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.137 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.06 106.47 18.54 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.213 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -101.65 118.98 38.05 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.251 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.406 ' CD1' HG12 ' A' ' 77' ' ' ILE . 2.2 t80 -88.95 118.5 28.72 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.822 179.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -130.63 116.16 17.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.764 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -80.85 -50.35 9.9 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.791 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.45 -63.7 0.02 OUTLIER 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.61 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.6 mp0 -109.54 -24.12 11.15 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.726 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.7 mp -103.4 138.83 39.6 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.79 0.328 . . . . 0.0 111.317 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 87.2 p -114.32 121.62 44.19 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.87 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.5 mp -124.44 134.28 67.12 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.712 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 14.6 tp -98.96 124.91 44.23 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.771 -0.195 . . . . 0.0 110.705 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.5 mt -65.0 103.42 0.73 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.912 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.1 mtmm -103.1 -31.78 9.99 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.703 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -148.08 173.85 12.52 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.779 0.323 . . . . 0.0 111.465 -179.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -56.94 -29.72 63.4 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.138 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -53.08 -41.74 65.19 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.036 179.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -68.39 -40.67 81.28 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.761 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 36.5 mt -63.52 -40.28 96.62 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.526 179.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.419 ' HA ' ' CD1' ' A' ' 63' ' ' ILE . 1.2 t0 -67.22 -37.62 83.9 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.163 179.627 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.47 -36.69 83.28 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.769 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.84 -37.71 87.86 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.185 179.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.419 ' CD1' ' HA ' ' A' ' 60' ' ' ASP . 11.1 mt -63.84 -44.29 98.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.951 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.03 -39.34 69.02 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.063 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 29.5 mt -66.79 -42.97 90.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.015 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 40.4 mt -67.45 -46.41 73.15 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.139 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -60.98 -38.94 87.76 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.369 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -65.69 -32.68 74.37 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.427 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 33.8 t -109.26 93.59 4.59 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.959 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.8 m -59.48 -27.28 65.98 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.765 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.0 t -57.67 -35.39 70.5 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.542 0.21 . . . . 0.0 111.282 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -117.21 163.17 16.7 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.762 0.315 . . . . 0.0 111.251 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -162.24 36.56 0.12 Allowed 'General case' 0 C--O 1.235 0.342 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.265 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' SER . . . . . 0.471 ' HB3' ' CD ' ' A' ' 7' ' ' LYS . 0.9 OUTLIER -143.18 149.11 37.57 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.708 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.415 HD21 ' CG1' ' A' ' 4' ' ' VAL . 0.1 OUTLIER -111.58 132.92 54.2 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.855 179.78 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.81 119.45 36.43 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.956 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.428 HD13 HG23 ' A' ' 77' ' ' ILE . 16.0 mt -128.45 118.33 47.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.873 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -106.3 122.17 45.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.955 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.449 HD22 ' CD1' ' A' ' 8' ' ' PHE . 3.0 pp -114.36 135.85 53.63 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.691 179.689 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.0 mp -114.3 144.35 43.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.792 -179.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -98.84 136.55 38.7 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.008 0.433 . . . . 0.0 110.999 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.51 6.05 39.66 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.123 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 8.4 p30 -61.97 87.86 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.005 0.431 . . . . 0.0 111.101 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? 59.01 35.38 24.01 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.3 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 68.37 170.7 0.28 Allowed 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.241 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -110.98 154.45 24.12 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.852 0.358 . . . . 0.0 111.414 -179.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.32 133.4 43.85 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.257 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -152.84 -55.11 0.12 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.136 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 67.75 -75.3 0.06 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.392 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -154.57 -57.96 0.11 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.546 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -139.51 164.3 30.25 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.183 179.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -162.0 -49.64 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.99 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.233 -0.889 . . . . 0.0 111.498 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 120.71 0.291 . . . . 0.0 111.406 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.4 t -108.03 78.82 1.21 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.07 0.462 . . . . 0.0 111.031 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -114.88 172.34 7.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.18 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.2 t -131.34 129.0 62.11 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.966 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.8 mtt-85 -88.5 112.72 23.31 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.952 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 6.2 mt -106.33 128.65 60.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.956 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.5 mtpt -104.04 125.23 50.23 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.586 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.431 ' CE1' HD11 ' A' ' 17' ' ' ILE . 20.6 m-85 -109.21 144.54 37.18 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.213 -179.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -121.77 124.0 43.16 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.294 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 12.1 t-160 -141.2 115.83 9.6 Favored 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.438 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 56.8 m-20 58.21 30.9 20.1 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 120.818 0.342 . . . . 0.0 111.137 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.9 -2.79 87.7 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 121.105 -0.569 . . . . 0.0 113.296 -179.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -85.64 143.08 28.63 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 117.216 0.508 . . . . 0.0 110.886 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.01 137.74 43.41 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.12 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -133.94 133.78 41.8 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.788 179.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.4 mp -114.07 117.29 55.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.073 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.431 HD11 ' CE1' ' A' ' 8' ' ' PHE . 10.9 mt -129.38 131.36 67.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.157 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -102.81 145.41 29.8 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.136 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -138.84 116.9 11.71 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.031 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.4 p -78.98 135.84 37.04 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.031 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.1 mtt180 -74.87 152.81 86.87 Favored Pre-proline 0 CA--C 1.531 0.243 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.844 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -72.79 129.04 16.46 Favored 'Cis proline' 0 C--N 1.35 0.611 0 C-N-CA 123.763 -1.349 . . . . 0.0 112.426 0.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 15.0 p -99.94 118.8 47.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.163 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.0 mmmt -91.32 132.44 36.17 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.979 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -54.44 -41.64 69.64 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.704 179.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -59.32 -45.32 91.64 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.051 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.69 -44.63 85.59 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.121 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 38.9 t -62.91 -47.94 90.39 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.918 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -60.78 -41.61 95.91 Favored 'General case' 0 N--CA 1.461 0.1 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.936 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -57.23 -48.43 78.85 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.119 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.9 tttt -68.62 -49.5 58.71 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.257 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 45.6 t -58.4 -44.67 89.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 CA-C-N 116.814 -0.176 . . . . 0.0 111.295 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 91.1 m -66.79 -39.38 87.76 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.192 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.4 m -72.15 -43.24 64.94 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.6 t -64.92 -51.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-O 120.463 0.173 . . . . 0.0 111.246 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -83.67 -20.37 33.67 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -179.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.401 ' O ' HD13 ' A' ' 40' ' ' LEU . . . 100.08 -179.77 29.95 Favored Glycine 0 C--N 1.338 0.656 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.521 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -139.55 156.36 71.39 Favored Pre-proline 0 N--CA 1.464 0.26 0 O-C-N 122.73 -0.276 . . . . 0.0 111.175 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -85.75 137.04 21.62 Favored 'Cis proline' 0 C--N 1.35 0.621 0 C-N-CA 123.438 -1.484 . . . . 0.0 112.897 0.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.401 HD13 ' O ' ' A' ' 37' ' ' GLY . 47.4 mt -137.9 130.07 28.96 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.515 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -103.68 138.78 39.84 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.9 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.2 mt -95.62 110.4 22.51 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.786 179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -111.09 126.71 55.12 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.954 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -89.14 126.33 35.42 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.722 179.736 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -131.2 118.55 20.59 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.617 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -83.61 -58.99 2.58 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.675 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -175.31 -52.29 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.544 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -109.37 -30.6 7.89 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.542 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.9 mp -112.41 154.77 25.27 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.788 0.328 . . . . 0.0 111.222 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -121.27 126.78 50.4 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.91 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 28.3 mm -113.75 134.44 56.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.859 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -96.59 126.7 41.95 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.792 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.415 HD13 HD12 ' A' ' 59' ' ' LEU . 0.5 OUTLIER -99.37 87.33 3.59 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 121.045 0.45 . . . . 0.0 110.835 179.939 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.3 mtpp -105.03 -34.2 8.06 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.138 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -103.92 163.49 12.33 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 120.78 0.324 . . . . 0.0 110.973 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.1 tm0? -63.34 -37.95 89.25 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.799 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.55 -38.54 84.82 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.206 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.62 -49.92 75.57 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.04 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.415 HD12 HD13 ' A' ' 53' ' ' LEU . 13.0 tp -63.89 -40.94 97.68 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.93 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.06 -37.62 84.35 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.213 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -62.66 -39.35 93.63 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.665 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.75 -38.27 90.47 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.088 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 25.2 mt -65.49 -41.9 92.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.141 179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.45 -39.59 67.57 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.037 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 45.1 mt -64.7 -38.37 82.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.949 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 15.9 mt -64.17 -45.37 88.73 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.828 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.86 -32.63 69.62 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.302 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.1 mtt-85 -66.09 -31.81 72.9 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.119 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.5 t -104.02 112.07 24.9 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.241 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.71 -33.4 71.57 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.461 179.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.8 p -72.79 -71.08 0.31 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.432 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.74 106.32 6.24 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 120.842 0.353 . . . . 0.0 111.384 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 25.1 pttt -114.74 -35.84 4.71 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.483 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.87 170.3 11.4 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 120.714 0.292 . . . . 0.0 111.526 -179.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.2 mp -114.9 133.5 55.93 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.399 -179.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -102.6 81.45 2.03 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.517 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.5 mt -106.42 129.64 59.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.016 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.2 pp -109.03 132.65 53.91 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.023 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.1 pp -111.15 135.9 50.99 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.634 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.6 mt -112.57 146.9 37.73 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.168 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.5 t -94.57 147.89 22.81 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.811 179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -80.07 5.28 14.63 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 112.378 0.511 . . . . 0.0 112.378 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 -125.6 70.84 1.2 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.909 0.385 . . . . 0.0 110.436 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.77 46.03 1.13 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.705 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -97.31 135.43 39.23 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.485 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 21.9 mt 66.63 172.72 0.25 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.049 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 58.88 90.0 0.05 Allowed 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.819 0.342 . . . . 0.0 111.381 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -121.76 109.73 15.07 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.213 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 71.8 t60 -127.14 -78.98 0.59 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.547 179.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 8.3 t60 43.77 77.23 0.07 Allowed 'General case' 0 C--O 1.234 0.288 0 C-N-CA 122.608 0.363 . . . . 0.0 111.617 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 65.24 -169.87 0.2 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.954 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -156.75 132.88 9.75 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.621 0.248 . . . . 0.0 111.402 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 67.7 m-70 . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.447 -0.787 . . . . 0.0 110.775 179.857 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 . . . . . 0 N--CA 1.489 1.494 0 CA-C-O 120.777 0.323 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.0 m -89.27 175.7 7.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.764 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 72.07 126.66 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.841 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.3 t -134.37 146.78 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.616 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -93.67 133.08 37.4 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.981 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 29.7 mt -114.76 136.4 51.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.918 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.7 mttt -108.25 122.39 46.84 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.753 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.445 ' CZ ' HG23 ' A' ' 32' ' ' VAL . 74.0 m-85 -116.66 139.89 50.02 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.873 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -119.34 131.37 55.71 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.1 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.6 t-160 -136.01 114.7 11.96 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.658 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 57.72 35.14 25.28 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.218 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 95.23 -35.22 4.38 Favored Glycine 0 C--N 1.337 0.635 0 C-N-CA 120.915 -0.66 . . . . 0.0 113.005 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.39 150.47 48.24 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.611 0.243 . . . . 0.0 111.135 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -118.37 141.01 48.97 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.221 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 91.9 mtt-85 -129.14 147.77 51.02 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.1 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 19.2 mt -115.03 126.45 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.087 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 9.2 tp -140.22 135.31 36.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.278 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -101.85 141.19 35.08 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.14 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -126.52 153.05 45.69 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.119 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 47.5 t -95.31 142.84 27.24 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.19 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -97.12 140.85 22.31 Favored Pre-proline 0 CA--C 1.53 0.208 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.633 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -74.6 143.89 79.24 Favored 'Cis proline' 0 C--N 1.351 0.695 0 C-N-CA 123.78 -1.342 . . . . 0.0 112.676 0.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.0 p -105.99 133.79 49.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.908 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.9 142.71 29.3 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.924 -179.664 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -60.34 -43.7 96.2 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.979 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -60.05 -41.88 93.29 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.951 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.95 -44.48 92.68 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.328 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 33.4 t -67.28 -47.47 81.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.78 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -57.87 -45.78 85.82 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.161 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -56.87 -47.3 80.75 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.102 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.9 tttt -67.09 -49.57 64.54 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.17 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.445 HG23 ' CZ ' ' A' ' 8' ' ' PHE . 47.9 t -58.26 -44.76 88.76 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.344 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 87.7 m -61.2 -40.42 93.88 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.151 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 20.5 m -72.54 -42.93 64.19 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 111.525 0.194 . . . . 0.0 111.525 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 62.1 t -62.54 -52.23 62.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -87.09 -18.77 29.73 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 98.11 179.66 32.78 Favored Glycine 0 C--N 1.337 0.622 0 C-N-CA 120.65 -0.785 . . . . 0.0 112.612 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.3 pm0 -140.36 154.14 69.38 Favored Pre-proline 0 N--CA 1.465 0.315 0 O-C-N 122.863 -0.198 . . . . 0.0 110.927 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -83.3 143.87 48.6 Favored 'Cis proline' 0 C--N 1.35 0.618 0 C-N-CA 123.525 -1.448 . . . . 0.0 113.033 0.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 17.8 mt -138.52 138.93 38.5 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.155 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -104.83 119.44 39.01 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.987 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.84 113.63 22.14 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.943 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -114.08 119.52 37.41 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.135 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -101.85 129.76 48.15 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.694 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.66 133.33 55.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.785 179.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -83.32 -59.65 2.39 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.521 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -149.97 -65.11 0.21 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.408 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -123.21 10.74 9.35 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.54 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -126.75 164.77 20.6 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.625 0.25 . . . . 0.0 111.114 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -121.06 118.43 29.77 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.888 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 22.3 mt -120.17 133.06 68.12 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.991 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.31 122.75 45.45 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.86 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.52 91.82 6.97 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.722 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.8 -32.17 16.2 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.397 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -116.1 162.33 17.58 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.758 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -62.31 -31.36 71.97 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.991 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -53.45 -46.0 69.72 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.771 0.319 . . . . 0.0 110.815 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.38 -37.36 87.22 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.299 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -61.24 -47.14 87.41 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.482 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -68.39 -32.15 72.02 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.151 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.0 tttm -62.64 -38.44 90.28 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.765 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.76 -36.11 82.62 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.069 179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 36.4 mm -59.36 -47.78 89.38 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.836 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -55.49 -42.61 74.65 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.917 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 9.9 mt -67.73 -43.09 86.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.141 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.959 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 13.9 tp -58.74 -45.57 89.37 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.83 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -65.83 -32.65 74.29 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.18 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.6 mmt180 -64.69 -33.51 76.13 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.32 179.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 42.2 t -103.36 111.25 23.58 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.184 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 51.6 p -62.49 -39.97 95.19 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.968 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 32.8 p -61.14 -34.65 75.34 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.435 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.5 ttp -90.89 92.52 8.81 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.715 0.293 . . . . 0.0 110.99 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -97.86 -34.63 10.78 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.169 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.2 m -92.2 166.71 12.49 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.838 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.8 mt -97.53 120.72 38.42 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.964 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -89.66 84.51 6.32 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.684 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 15.2 mt -117.72 124.14 72.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.126 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.3 tp -111.38 117.37 32.91 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.813 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.3 pp -103.3 136.18 43.56 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.847 0.356 . . . . 0.0 111.158 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.7 mp -119.26 158.13 26.66 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.156 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -88.91 137.1 32.62 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.076 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 48.4 tp60 -88.09 4.62 44.66 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.806 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -139.5 25.84 2.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.913 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 5.4 mtm180 -167.16 82.83 0.22 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.011 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -140.67 133.79 29.45 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.136 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.6 mt -174.72 -38.35 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.292 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -54.98 158.37 2.83 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.944 0.402 . . . . 0.0 111.957 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -78.16 172.99 12.73 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.472 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 40.3 t60 -108.66 -53.15 2.67 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.203 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 65.48 100.12 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.631 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -107.57 168.28 9.36 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.976 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 13.0 m170 68.41 -76.28 0.06 Allowed 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 122.913 0.485 . . . . 0.0 111.198 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 39.1 t60 . . . . . 0 C--O 1.251 1.155 0 CA-C-O 118.341 -0.838 . . . . 0.0 110.8 179.705 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 120.627 0.251 . . . . 0.0 111.345 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.421 ' O ' ' HB2' ' A' ' 3' ' ' ASP . 61.7 p -170.54 161.84 7.89 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.815 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 2' ' ' SER . 1.1 m-20 69.53 146.7 0.06 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.407 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.7 t -140.16 127.38 23.62 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.003 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.1 120.08 28.0 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.917 0.389 . . . . 0.0 111.172 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 30.2 mm -106.27 117.7 52.52 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.055 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.0 mttt -101.87 111.56 23.86 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.541 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.451 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 1.8 p90 -117.0 142.58 46.77 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.179 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -122.39 140.07 53.12 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.444 -179.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.2 t-160 -140.94 113.39 8.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.439 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.2 m120 59.76 31.42 20.81 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.541 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 104.18 -43.95 1.57 Allowed Glycine 0 C--N 1.335 0.505 0 C-N-CA 120.847 -0.692 . . . . 0.0 113.223 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -70.96 135.85 48.14 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.762 0.281 . . . . 0.0 111.119 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -119.24 156.73 29.39 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.787 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.451 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 1.1 tpt180 -141.39 143.74 34.11 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.285 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.4 mt -116.9 118.93 60.44 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.054 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 27.4 mm -129.95 137.58 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-O 120.746 0.308 . . . . 0.0 111.262 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.09 145.95 24.62 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.228 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -133.37 117.88 17.79 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.166 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 65.7 m -72.95 136.13 45.13 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.243 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 44.1 mtm180 -100.45 156.83 34.77 Favored Pre-proline 0 CA--C 1.53 0.182 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.006 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.18 122.28 8.11 Favored 'Cis proline' 0 C--N 1.35 0.654 0 C-N-CA 123.258 -1.559 . . . . 0.0 112.657 0.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.7 p -104.36 153.23 6.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.168 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -104.81 137.02 43.23 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.685 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -54.88 -37.06 65.81 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.67 179.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -58.52 -45.1 89.52 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.002 179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -67.33 -44.66 78.55 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.161 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.0 t -62.34 -47.32 93.59 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.127 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.85 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.27 -44.25 95.48 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.906 179.583 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -56.8 -40.92 76.83 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.098 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.64 -49.47 62.77 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.167 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.5 t -64.79 -41.29 91.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.373 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 96.5 m -60.17 -39.52 86.71 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.158 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 16.5 m -71.89 -29.09 63.97 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 121.238 -0.185 . . . . 0.0 111.344 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 44.8 t -69.37 -53.67 23.87 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-O 120.583 0.23 . . . . 0.0 111.449 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -94.18 -11.22 30.83 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -178.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.92 177.39 28.04 Favored Glycine 0 C--N 1.335 0.504 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.646 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -129.46 153.89 80.68 Favored Pre-proline 0 C--O 1.233 0.227 0 CA-C-O 120.623 0.249 . . . . 0.0 111.18 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.412 ' CG ' ' HB2' ' A' ' 84' ' ' ARG . 95.5 Cg_endo -89.12 136.1 12.6 Favored 'Cis proline' 0 C--N 1.349 0.582 0 C-N-CA 123.494 -1.461 . . . . 0.0 112.919 0.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 55.3 mt -138.03 136.14 36.58 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.722 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -115.19 140.55 48.99 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.051 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 mp -81.74 112.31 18.79 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.508 179.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -101.36 129.86 47.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -88.88 124.42 34.19 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-O 120.742 0.306 . . . . 0.0 111.32 -179.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 4.6 tpp -126.23 107.74 10.64 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.771 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.2 m-20 -78.91 -60.81 2.23 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.863 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -154.92 -59.07 0.11 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.573 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.43 11.78 6.38 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.553 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -131.59 152.49 50.75 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.648 0.261 . . . . 0.0 111.428 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 t -120.18 126.64 51.16 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.924 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.4 mt -114.1 134.33 57.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.855 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -93.84 126.78 39.23 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.85 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -100.54 96.77 7.6 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.033 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.4 tttm -93.98 -32.92 13.64 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.277 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.0 m-20 -136.99 173.2 11.95 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.754 0.311 . . . . 0.0 111.14 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -60.25 -29.81 69.02 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.958 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -53.65 -43.94 69.18 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.093 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -66.88 -38.37 86.17 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.645 179.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.44 -45.32 91.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.162 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.14 -41.32 98.16 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.194 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -62.32 -38.82 90.89 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.65 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.6 -41.32 98.34 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.584 179.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.2 mt -63.55 -44.63 98.73 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-O 120.66 0.267 . . . . 0.0 110.762 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.39 -42.3 77.7 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.174 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.1 mt -68.02 -42.41 85.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.087 179.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 10.0 tp -59.62 -46.21 89.67 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.976 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.37 -35.62 70.21 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.24 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.62 -31.74 63.7 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.098 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.7 t -64.76 141.42 58.78 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.439 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.5 t -70.3 -30.73 67.8 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.772 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 47.7 p -92.7 37.11 1.01 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.881 0.372 . . . . 0.0 111.484 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -72.0 140.76 49.24 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.977 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -179.04 -43.3 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.073 179.677 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 64.1 m -147.14 178.06 8.68 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.798 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.7 mp -106.72 119.36 39.12 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.89 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.0 ttp180 -82.56 77.94 9.26 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.995 0.426 . . . . 0.0 110.608 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.4 ' O ' ' HA ' ' A' ' 8' ' ' PHE . 22.1 mt -104.4 118.58 51.89 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.883 -179.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -102.2 127.42 49.14 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.048 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.3 pp -111.15 131.13 55.35 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.046 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 mp -140.87 151.15 44.08 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.873 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.79 132.7 47.9 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.993 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.82 5.34 46.57 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.288 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 60.76 100.52 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.777 179.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.412 ' HB2' ' CG ' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -144.15 50.59 1.32 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.09 179.963 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 61.62 -177.0 0.12 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.472 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.1 mp -107.46 60.73 0.62 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.697 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.429 ' O ' ' HB2' ' A' ' 88' ' ' HIS . 0.2 OUTLIER 58.47 -166.85 0.15 Allowed 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.859 -179.694 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.429 ' HB2' ' O ' ' A' ' 87' ' ' GLU . 33.8 m170 70.6 136.61 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.863 0.363 . . . . 0.0 110.945 -179.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 21.2 m-70 -63.26 103.01 0.45 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.486 -179.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.35 33.29 0.72 Allowed 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.078 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -174.52 178.48 1.95 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.005 -179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -146.19 54.1 1.14 Allowed 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 121.018 0.437 . . . . 0.0 110.883 179.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.226 -0.893 . . . . 0.0 110.767 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 120.813 0.339 . . . . 0.0 111.314 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 87.2 p -113.14 179.45 3.96 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.705 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.6 t70 63.88 94.55 0.05 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.98 0.419 . . . . 0.0 111.053 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.4 t -81.0 125.02 39.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.016 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.11 115.47 29.09 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.604 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 3.8 mp -110.1 134.05 53.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.059 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.64 114.95 29.08 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.679 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -103.2 127.03 50.64 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.775 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -120.33 124.05 44.61 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.916 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.8 t-160 -139.27 116.23 10.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.547 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.27 31.7 21.38 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.174 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.66 -28.79 9.42 Favored Glycine 0 C--N 1.339 0.695 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.867 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -65.03 137.4 57.68 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.796 0.331 . . . . 0.0 111.098 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -110.23 136.05 50.04 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.014 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.1 mtp180 -130.03 136.49 49.45 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.96 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.5 mp -114.38 117.4 55.46 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.873 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 19.9 mt -131.87 137.06 55.78 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 CA-C-O 120.828 0.347 . . . . 0.0 111.27 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -101.67 132.54 47.31 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.079 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -124.96 126.48 45.54 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.977 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.1 m -72.78 153.89 40.9 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.375 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.5 mtt180 -95.48 146.98 32.27 Favored Pre-proline 0 CA--C 1.53 0.208 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.166 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -78.24 124.08 10.25 Favored 'Cis proline' 0 C--N 1.349 0.569 0 C-N-CA 123.313 -1.536 . . . . 0.0 112.49 -0.052 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.0 p -69.34 126.88 30.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.99 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.1 mmmt -102.18 147.69 26.33 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.029 -179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -60.42 -40.18 90.09 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.65 179.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -62.23 -44.71 95.94 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.246 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.85 -44.35 96.37 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.189 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.9 t -65.86 -46.92 87.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.479 179.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -63.11 -42.15 99.5 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.266 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -56.2 -43.07 78.15 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.56 0.219 . . . . 0.0 111.471 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -70.38 -49.7 46.36 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.183 179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 38.6 t -62.4 -40.98 90.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.463 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.41 ' CG2' ' HB3' ' A' ' 38' ' ' GLN . 52.4 m -61.8 -43.02 99.68 Favored 'General case' 0 C--O 1.226 -0.182 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.194 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 40.1 m -72.44 -44.18 62.76 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 111.533 0.197 . . . . 0.0 111.533 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 65.2 t -63.53 -48.43 86.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.416 ' HB2' ' CD1' ' A' ' 40' ' ' LEU . 68.7 m-85 -102.37 10.12 39.3 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -178.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.26 173.41 16.03 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.775 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.41 ' HB3' ' CG2' ' A' ' 33' ' ' THR . 0.0 OUTLIER -127.86 157.96 71.99 Favored Pre-proline 0 N--CA 1.464 0.229 0 O-C-N 122.814 -0.227 . . . . 0.0 110.763 179.93 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -89.34 153.3 30.54 Favored 'Cis proline' 0 C--N 1.35 0.611 0 C-N-CA 123.803 -1.332 . . . . 0.0 113.351 0.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.416 ' CD1' ' HB2' ' A' ' 36' ' ' PHE . 51.9 mt -138.32 159.17 42.74 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.134 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -114.16 134.88 54.6 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.706 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 50.7 mt -92.59 107.15 19.0 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.739 0.304 . . . . 0.0 110.834 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -113.78 129.58 56.56 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.279 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -108.27 124.3 50.11 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.477 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.0 ptm -126.18 130.83 51.77 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.855 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -89.92 -71.45 0.61 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.165 -179.525 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -142.13 -71.89 0.33 Allowed 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.553 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -117.53 16.73 14.61 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.128 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.1 mt -131.59 143.74 50.56 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.611 0.244 . . . . 0.0 110.924 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.67 126.61 54.69 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.93 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.8 mp -122.75 132.73 70.73 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.109 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.1 tt -102.69 135.66 43.93 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.798 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -109.13 110.22 21.41 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.914 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.56 -36.14 9.28 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.23 179.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -129.72 174.06 10.05 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.07 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -56.61 -33.86 66.67 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.028 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -54.44 -46.06 73.17 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 123.277 0.36 . . . . 0.0 110.956 179.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -61.92 -43.9 97.88 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.804 179.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 22.9 tp -69.01 -37.95 78.98 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.377 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -61.74 -43.09 99.53 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.935 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.58 -33.72 75.59 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.971 179.466 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.55 -35.63 80.08 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.402 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 13.4 mt -65.93 -44.91 92.33 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 CA-C-O 120.642 0.258 . . . . 0.0 110.468 179.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -41.63 89.14 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.948 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 11.0 mt -67.6 -41.68 85.92 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.111 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.9 tp -59.98 -47.32 86.29 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.85 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -67.63 -36.74 81.36 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.79 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 -66.21 -27.54 68.06 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.577 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 32.6 t -58.77 147.43 33.36 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.93 0.395 . . . . 0.0 111.629 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.6 p -71.33 -31.1 66.99 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.35 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.4 t -144.28 85.85 1.81 Allowed 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.955 0.407 . . . . 0.0 110.862 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 6.6 ttt -171.07 100.87 0.21 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.09 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.13 -35.1 10.12 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.234 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -98.54 159.02 15.23 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.61 0.243 . . . . 0.0 110.771 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.93 126.41 37.0 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.816 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -86.48 86.43 7.34 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.772 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 30.5 mm -104.15 128.22 57.75 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.052 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -114.58 118.74 34.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.688 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.18 131.9 54.18 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.456 179.773 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.1 pp -125.59 151.1 46.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.09 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.1 p -65.57 146.92 54.24 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.067 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -82.77 5.53 21.16 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -91.29 50.57 1.77 Allowed 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.004 0.431 . . . . 0.0 111.151 179.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.2 ttt85 -112.44 58.13 0.65 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.017 179.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -73.47 102.7 3.87 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.874 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.44 -49.13 2.38 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.99 -179.69 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -90.05 136.3 33.13 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.107 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -113.32 110.51 20.47 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.714 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 19.5 m170 -104.48 141.29 36.63 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.223 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -162.28 88.88 0.67 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.92 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -102.74 33.88 3.04 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.956 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 64.5 t-80 -152.95 96.12 2.05 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.473 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 1.2 t60 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.113 -0.946 . . . . 0.0 111.068 -179.756 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 120.555 0.217 . . . . 0.0 111.305 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.6 m 68.56 174.33 0.28 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.966 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 66.08 105.01 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.999 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.4 t -111.03 100.19 10.25 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.988 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.6 mtt180 -89.34 108.63 19.74 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.799 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 7.0 mt -106.46 134.59 47.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.216 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.9 mmtt -103.1 121.29 42.31 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.735 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -109.41 138.45 45.75 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.974 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -119.28 126.0 50.43 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.18 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -138.04 121.0 16.59 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.608 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 59.09 31.63 21.47 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.26 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.2 -35.78 3.98 Favored Glycine 0 C--N 1.337 0.638 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.775 -179.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -66.99 146.35 54.47 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.871 0.367 . . . . 0.0 111.219 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.6 mtm105 -113.51 147.18 38.39 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.361 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.94 136.28 40.3 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.087 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.6 mp -116.74 118.26 58.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.906 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.6 mt -127.98 136.49 60.13 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-O 120.863 0.363 . . . . 0.0 111.313 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.6 143.83 26.36 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.249 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.3 m-85 -130.79 133.66 46.17 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.08 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.88 132.58 35.22 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.986 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.5 mtt180 -80.74 155.44 73.3 Favored Pre-proline 0 N--CA 1.464 0.226 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.087 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -72.75 124.68 9.44 Favored 'Cis proline' 0 C--N 1.349 0.579 0 C-N-CA 123.67 -1.388 . . . . 0.0 112.379 0.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.1 p -72.7 141.79 15.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.226 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.0 mmtt -118.59 128.44 54.56 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.9 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -57.41 -36.59 71.52 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.78 179.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.26 -44.77 94.2 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.089 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -69.05 -44.36 72.8 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.124 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 38.6 t -66.43 -47.47 83.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.151 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -61.47 -45.64 93.42 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.125 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -62.66 -45.2 93.91 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.723 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.36 -49.34 74.26 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.408 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 56.0 t -60.94 -42.65 93.65 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.377 -179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 92.1 m -61.98 -39.46 92.26 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.056 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.8 m -72.28 -41.4 66.73 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 111.6 0.222 . . . . 0.0 111.6 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 50.7 t -60.0 -52.49 60.57 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-O 120.575 0.226 . . . . 0.0 111.545 -179.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.419 ' CE2' HD21 ' A' ' 79' ' ' LEU . 87.3 m-85 -88.42 -23.24 23.37 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -179.047 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.417 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 104.25 -176.08 23.26 Favored Glycine 0 CA--C 1.523 0.588 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.371 -179.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -137.35 156.79 75.02 Favored Pre-proline 0 N--CA 1.466 0.349 0 CA-C-O 120.624 0.249 . . . . 0.0 111.134 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -85.85 140.17 26.64 Favored 'Cis proline' 0 C--N 1.349 0.574 0 C-N-CA 123.451 -1.479 . . . . 0.0 112.979 0.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.417 HD12 ' O ' ' A' ' 37' ' ' GLY . 21.8 mt -137.73 139.14 39.97 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.947 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -106.65 136.88 45.69 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.163 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 66.7 mt -86.54 108.74 18.7 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.048 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -112.23 119.96 40.13 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.899 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -106.33 130.06 54.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.562 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.1 ppp? -130.6 122.81 28.15 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.953 0.406 . . . . 0.0 110.937 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -79.12 -41.43 28.6 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.529 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -170.24 -67.18 0.02 OUTLIER 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.553 179.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -111.44 -24.64 10.05 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.634 179.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -105.74 138.77 41.38 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.656 0.265 . . . . 0.0 111.328 -179.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.0 t -110.09 131.06 55.39 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.711 179.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.3 mt -113.56 134.16 57.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.604 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.0 mt -84.47 118.04 24.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.034 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -86.33 100.0 11.99 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.312 179.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.6 mttt -135.22 25.22 3.53 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.932 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -173.5 157.18 3.17 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.653 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -61.09 -32.33 72.0 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.654 179.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.75 -45.82 81.77 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.888 179.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -60.47 -42.29 95.95 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.814 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 13.6 tp -66.71 -42.6 86.12 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.804 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.73 -38.88 92.23 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.379 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -39.93 95.67 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.804 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.99 -36.33 83.18 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.096 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 14.4 mt -65.18 -44.22 95.38 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.139 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.826 179.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -55.44 -45.78 76.77 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.082 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 10.7 mt -67.19 -40.44 85.15 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.607 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.0 -44.1 93.68 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.002 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -57.2 -34.58 68.65 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.183 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.2 mtp85 -73.66 -31.36 63.44 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.474 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.8 t -96.36 101.03 12.6 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.367 -179.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.7 t -59.74 -38.44 81.74 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.18 179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 56.3 p -59.12 -36.12 74.63 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.236 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.34 149.36 30.3 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.065 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 22.3 mttp -144.0 -47.23 0.27 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.148 179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 95.4 p -101.89 167.65 9.93 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.95 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.1 mt -104.91 130.7 53.02 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.049 -179.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.33 81.26 8.43 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.938 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.3 mt -102.69 116.78 47.02 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.685 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 46.3 mt -101.95 117.34 34.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.614 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.419 HD21 ' CE2' ' A' ' 36' ' ' PHE . 1.8 pp -101.92 131.85 48.06 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.902 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.2 mp -129.35 155.12 46.14 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.027 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.75 146.31 54.93 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.913 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.65 5.39 21.27 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.266 -0.425 . . . . 0.0 112.093 179.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -108.33 88.22 2.68 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.843 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 26.6 mtm-85 -100.57 35.46 2.14 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.316 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -133.21 56.4 1.85 Allowed 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.895 0.379 . . . . 0.0 111.26 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.1 tp -152.12 31.01 0.55 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.33 179.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -168.38 39.27 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 120.79 0.329 . . . . 0.0 111.48 179.731 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -80.28 125.45 29.89 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.847 0.356 . . . . 0.0 111.496 -179.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 33.2 p80 -107.02 134.75 49.7 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.971 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 28.1 m80 61.36 177.65 0.11 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.49 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 33.4 m80 -144.85 -50.66 0.27 Allowed 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.189 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -134.68 28.3 3.61 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.742 0.306 . . . . 0.0 111.327 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 3.3 t60 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 117.796 -1.097 . . . . 0.0 111.018 -179.879 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 120.47 0.176 . . . . 0.0 111.125 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 m 68.69 164.4 0.24 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.072 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 57.34 93.26 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.308 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.2 t -108.56 128.59 64.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.447 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.6 mtt180 -89.88 113.23 24.8 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.796 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 3.0 mt -103.34 133.83 46.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.145 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -94.13 128.54 40.6 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.757 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -116.96 132.23 56.75 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.909 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -119.09 123.46 44.5 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.04 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 -129.35 118.0 21.53 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.734 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 57.92 33.68 23.47 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.472 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.67 -29.08 9.57 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.989 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -64.79 148.3 51.51 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.707 0.289 . . . . 0.0 111.131 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.2 mtp180 -120.35 134.55 55.24 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.136 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 50.8 mtp180 -142.99 149.61 38.54 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.305 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.0 mt -114.46 133.76 59.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.242 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 23.8 mt -137.58 130.76 42.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.209 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.78 141.34 28.55 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.199 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -137.48 132.42 33.28 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.132 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.5 m -84.55 125.41 32.39 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.869 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 54.9 mtm180 -89.44 154.67 48.78 Favored Pre-proline 0 CA--C 1.529 0.155 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.116 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -74.61 121.07 6.98 Favored 'Cis proline' 0 C--N 1.351 0.663 0 C-N-CA 123.725 -1.365 . . . . 0.0 112.506 0.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.8 p -101.77 131.36 49.84 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.8 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp -78.28 144.56 36.03 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.825 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -56.77 -39.56 74.28 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.79 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.404 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -62.9 -36.01 81.95 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.15 179.696 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -67.92 -44.1 77.65 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 116.697 -0.228 . . . . 0.0 110.98 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 31.6 t -63.84 -47.33 91.26 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.956 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.404 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 13.0 pt-20 -66.75 -35.08 79.27 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.085 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -56.43 -45.39 80.77 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.628 0.251 . . . . 0.0 110.852 179.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.4 mmmt -68.25 -49.26 61.82 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.91 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.1 t -61.25 -40.67 86.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.477 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 98.1 m -66.45 -41.72 88.67 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.069 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.3 m -72.63 -43.53 63.11 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 111.68 0.252 . . . . 0.0 111.68 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.7 t -66.28 -44.06 91.33 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -179.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -103.46 10.88 37.03 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -179.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.02 171.16 10.76 Favored Glycine 0 C--N 1.338 0.673 0 C-N-CA 120.736 -0.745 . . . . 0.0 113.057 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -120.29 159.19 48.65 Favored Pre-proline 0 N--CA 1.466 0.337 0 O-C-N 122.821 -0.223 . . . . 0.0 110.785 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -89.05 153.69 32.31 Favored 'Cis proline' 0 C--N 1.351 0.662 0 C-N-CA 123.846 -1.314 . . . . 0.0 113.477 0.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 48.3 mt -138.19 133.17 32.92 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.977 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -105.77 134.78 48.34 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.808 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.2 102.71 14.75 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.146 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -101.5 122.12 43.22 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.229 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -103.78 130.52 51.32 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.725 179.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 8.3 mtt -117.22 124.12 48.3 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.623 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -84.92 -61.92 1.66 Allowed 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.225 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -164.12 -64.12 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.694 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -112.83 -13.38 13.19 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.524 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.7 tp -120.44 143.76 48.32 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-O 120.69 0.281 . . . . 0.0 111.319 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.4 m -100.89 124.71 46.98 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.751 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.4 mt -118.59 133.51 65.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.001 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 14.1 tp -103.38 134.5 46.65 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.84 179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.6 mp -84.89 84.31 7.75 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.751 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -90.28 -35.11 15.47 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.207 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -120.86 159.65 25.06 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.914 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.5 tm0? -60.16 -33.75 72.61 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.962 179.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.57 -40.61 79.32 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.093 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.67 -42.72 97.63 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.778 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 tp -68.46 -40.06 81.18 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.953 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.33 -43.38 98.96 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.075 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.68 -35.74 79.39 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.85 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.64 -40.21 96.31 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.542 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 13.8 mt -64.16 -41.17 91.59 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 116.732 -0.213 . . . . 0.0 111.008 179.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -54.84 -40.13 69.29 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.028 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 44.4 mt -67.85 -42.01 85.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.811 179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.4 tp -65.54 -45.88 81.73 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.729 179.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.56 -39.63 77.12 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.105 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.1 mmt-85 -61.93 -34.37 75.96 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.213 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 42.5 t -84.8 105.26 15.45 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.907 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 85.6 p -67.59 -32.16 72.72 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.017 179.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.2 t -67.32 -43.14 82.35 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.953 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.42 120.98 25.68 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.103 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.46 -40.09 4.74 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.185 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 53.6 p -91.6 167.51 12.16 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.66 -0.246 . . . . 0.0 111.111 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -107.57 131.12 54.69 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.23 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -91.41 86.8 6.2 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.69 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 29.4 mt -117.95 129.3 74.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.004 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.99 117.58 32.44 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.836 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.0 131.04 45.34 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.97 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 pp -122.93 130.57 53.0 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.705 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.4 t -75.99 135.7 40.0 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.767 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 34.8 tp60 -87.83 6.19 36.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.989 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -59.48 89.26 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.258 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.2 ttp85 -122.14 -49.47 2.06 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.59 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 68.88 111.01 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.519 179.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.447 ' HB3' ' CE1' ' A' ' 90' ' ' HIS . 6.2 tp -81.2 160.47 24.32 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.538 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -110.94 -54.86 2.56 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.299 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -104.96 157.16 17.41 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.805 0.336 . . . . 0.0 111.294 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.06 89.5 0.09 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.291 179.701 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.447 ' CE1' ' HB3' ' A' ' 86' ' ' LEU . 0.0 OUTLIER -146.43 -49.46 0.2 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.996 179.938 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 14.4 p80 -99.51 162.57 12.95 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.372 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -100.2 153.73 19.03 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.339 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.251 1.138 0 CA-C-O 118.587 -0.72 . . . . 0.0 111.226 179.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 . . . . . 0 N--CA 1.49 1.526 0 CA-C-O 120.689 0.28 . . . . 0.0 111.139 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.7 m 57.09 40.13 28.64 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.987 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -158.36 76.89 0.77 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.498 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 38.2 t -77.68 128.89 37.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.584 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 23.2 mtm180 -93.14 115.59 28.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.805 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 24.7 mt -108.31 128.68 63.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.856 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 39.4 mttt -106.23 126.99 52.9 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.009 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.407 ' CZ ' HG21 ' A' ' 32' ' ' VAL . 89.2 m-85 -114.43 143.28 45.17 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.083 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -128.02 127.99 44.18 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.997 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.0 t-160 -143.1 118.88 10.51 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.602 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 58.4 37.29 25.79 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.345 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 91.57 -47.14 2.78 Favored Glycine 0 C--N 1.334 0.437 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.719 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.49 141.14 52.0 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.733 0.301 . . . . 0.0 110.92 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -125.06 149.75 47.49 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.323 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.51 139.46 50.5 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.948 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.4 mp -99.73 133.23 43.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.954 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 9.1 tp -129.46 137.58 56.51 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.395 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.87 131.38 35.83 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.994 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -132.34 125.81 31.77 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.228 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.4 m -98.86 142.84 29.87 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.882 179.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 68.4 mtt180 -74.02 151.15 88.32 Favored Pre-proline 0 N--CA 1.464 0.245 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.948 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.75 125.87 12.47 Favored 'Cis proline' 0 C--N 1.352 0.715 0 C-N-CA 123.474 -1.469 . . . . 0.0 112.658 0.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.9 p -89.61 114.94 28.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.077 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -99.66 137.16 38.53 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.106 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -56.47 -40.31 74.64 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.141 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -63.57 -44.75 93.17 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.101 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -66.36 -44.28 83.62 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.374 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 43.1 t -65.35 -47.66 86.19 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.721 179.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -59.89 -42.66 94.31 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.095 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.82 -42.4 79.53 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.056 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.9 mtpt -69.49 -49.63 52.92 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.028 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.407 HG21 ' CZ ' ' A' ' 8' ' ' PHE . 34.9 t -61.3 -40.55 86.49 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.441 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 88.5 m -59.3 -41.73 89.69 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.844 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 48.7 m -72.13 -31.76 66.3 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 111.464 0.172 . . . . 0.0 111.464 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.1 t -63.95 -55.88 19.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 111.632 0.234 . . . . 0.0 111.632 -179.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.459 ' HB2' HD13 ' A' ' 40' ' ' LEU . 77.7 m-85 -97.56 -10.66 24.8 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 -178.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.97 -172.41 24.55 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.475 -179.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -143.65 156.81 59.6 Favored Pre-proline 0 N--CA 1.465 0.277 0 O-C-N 122.83 -0.218 . . . . 0.0 111.338 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -81.44 153.31 80.08 Favored 'Cis proline' 0 C--N 1.35 0.636 0 C-N-CA 123.803 -1.332 . . . . 0.0 112.884 0.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.459 HD13 ' HB2' ' A' ' 36' ' ' PHE . 48.0 mt -136.01 149.08 48.69 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.029 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -116.0 120.23 38.47 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.793 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 73.2 mt -81.95 97.29 8.01 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.727 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -97.9 113.71 25.61 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.286 -179.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 14.1 t80 -98.85 123.56 43.19 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.717 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.4 mtt -126.23 131.86 51.85 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.673 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -76.91 -43.92 33.73 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.631 179.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -173.93 -49.85 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.605 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -119.34 -36.58 3.33 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.375 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.8 mp -95.26 134.14 38.36 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.827 0.346 . . . . 0.0 111.24 -179.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 98.1 p -105.04 121.2 43.29 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.844 179.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.4 mt -114.75 132.49 63.77 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.86 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.9 tt -88.26 132.91 34.2 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.658 179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.4 mt -103.01 94.67 5.67 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.69 179.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.07 27.66 9.38 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.486 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -173.45 164.92 4.65 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.919 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.42 -37.15 86.53 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.548 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -58.51 -40.9 84.16 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.653 -0.249 . . . . 0.0 110.909 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -65.79 -43.79 87.67 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.781 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.2 tp -67.21 -41.76 85.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.802 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -63.85 -43.1 97.16 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.932 179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.4 tttm -63.87 -32.13 73.54 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.411 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.77 -40.38 97.09 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.389 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 5.0 mt -64.42 -40.92 90.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.935 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -55.32 -34.95 64.62 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.001 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 41.7 mt -65.96 -40.92 88.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.085 179.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 12.4 tp -65.33 -45.02 85.93 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.768 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -56.97 -39.42 74.57 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.608 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -65.05 -32.76 74.64 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.203 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.5 t -70.04 146.5 50.95 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.809 0.338 . . . . 0.0 111.278 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 2.3 m -76.3 -34.82 59.06 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.426 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.3 p -77.79 -52.23 9.24 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.285 -179.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 13.9 ptt? 40.56 86.46 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.547 0 O-C-N 123.484 0.49 . . . . 0.0 112.223 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.09 82.78 2.07 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.961 0.41 . . . . 0.0 111.173 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 63.28 -179.37 0.15 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.44 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -122.31 122.47 39.15 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.077 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.3 mtt180 -83.4 93.81 7.84 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.004 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.3 mt -109.06 128.09 65.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.869 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.5 mp -103.64 126.45 50.79 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.192 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.8 pp -111.13 136.22 50.5 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.786 0.327 . . . . 0.0 111.169 179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.1 mp -128.95 155.38 45.42 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.976 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -85.9 141.44 29.57 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.162 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -87.85 5.66 39.23 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.995 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -145.26 76.54 1.49 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.531 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -112.05 24.09 13.02 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.638 -179.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -146.86 105.31 3.8 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.637 0.256 . . . . 0.0 111.09 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.3 pp -89.29 115.83 27.06 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.809 0.337 . . . . 0.0 110.914 179.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -127.04 103.98 7.74 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.701 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -111.73 -174.89 2.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.884 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 4.4 t-160 -92.38 37.94 1.0 Allowed 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.326 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -100.79 74.07 1.62 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.953 0.406 . . . . 0.0 110.386 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 81.9 m-70 -65.13 156.12 32.66 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.198 -179.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 9.7 p-80 -99.47 108.84 21.39 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.806 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 17.3 p80 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.054 -0.974 . . . . 0.0 111.35 -179.758 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 120.597 0.237 . . . . 0.0 111.418 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.6 t -149.86 147.53 28.06 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.988 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 60.78 92.43 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.064 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.8 t -84.27 124.42 39.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.033 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.36 117.44 29.91 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.858 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.3 mt -103.64 130.42 54.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.12 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 tmtt? -110.55 114.42 27.82 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.711 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 12.2 p90 -113.34 146.96 38.58 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.079 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -124.48 143.95 50.37 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.106 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -140.39 111.84 7.3 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.678 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 54.58 34.49 21.4 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.645 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 104.75 -42.48 1.89 Allowed Glycine 0 C--N 1.334 0.459 0 C-N-CA 120.921 -0.657 . . . . 0.0 112.741 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.55 135.46 56.02 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.689 0.28 . . . . 0.0 111.076 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -115.05 154.08 29.52 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.596 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -151.79 136.37 16.98 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.157 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.7 mt -114.38 126.56 71.94 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.135 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 26.2 mm -130.63 131.13 64.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.12 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.66 134.05 39.01 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.13 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -126.94 124.19 38.92 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.201 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -80.87 150.26 29.15 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.052 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.42 152.01 43.26 Favored Pre-proline 0 CA--C 1.532 0.274 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.256 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -76.04 131.3 23.82 Favored 'Cis proline' 0 C--N 1.35 0.629 0 C-N-CA 123.233 -1.57 . . . . 0.0 112.318 -0.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.9 p -119.96 123.55 71.04 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.043 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.7 mttp -91.79 151.09 20.76 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.08 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -62.65 -35.99 81.42 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.895 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -63.37 -44.66 94.14 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.987 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.67 -44.4 93.88 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.392 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 39.4 t -67.73 -47.62 79.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 120.777 0.322 . . . . 0.0 110.685 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -63.42 -44.5 94.42 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.36 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -56.33 -39.04 72.17 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.471 -179.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.7 tttt -64.13 -47.58 79.39 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-O 120.64 0.257 . . . . 0.0 110.556 179.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 20.7 t -63.52 -40.25 88.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.691 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -59.28 -40.69 86.91 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 116.856 -0.156 . . . . 0.0 111.112 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.9 m -72.47 -33.25 66.87 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.436 0.16 . . . . 0.0 111.088 179.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 44.7 t -68.03 -53.1 32.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -99.85 9.12 43.52 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.86 176.46 26.41 Favored Glycine 0 C--N 1.335 0.524 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.877 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -124.35 158.54 60.95 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-O 120.467 0.175 . . . . 0.0 110.944 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -90.07 153.51 27.53 Favored 'Cis proline' 0 C--N 1.348 0.526 0 C-N-CA 123.901 -1.291 . . . . 0.0 113.175 0.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.4 HD21 ' CB ' ' A' ' 81' ' ' SER . 78.1 mt -138.54 148.35 44.14 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.942 179.573 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -115.16 123.58 49.28 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.663 179.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 81.1 mt -88.32 102.01 14.44 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.182 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -96.59 122.01 39.05 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.024 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -104.3 119.04 38.07 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.47 179.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 27.6 mmm -94.32 130.97 40.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.768 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -82.5 -50.39 8.89 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.874 0.369 . . . . 0.0 110.348 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -172.41 -63.51 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.009 179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -107.14 -28.95 9.65 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.485 179.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.6 mt -109.12 162.98 13.75 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.919 0.39 . . . . 0.0 111.525 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.24 125.39 53.04 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.186 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.6 mm -116.61 132.7 65.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.944 179.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 37.6 tp -94.75 126.55 40.14 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.841 179.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 15.6 mt -79.93 131.67 35.88 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.727 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.4 mmtt -108.04 -38.39 5.8 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.393 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 39.3 p30 -152.78 -172.3 4.2 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.041 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -55.98 -36.35 67.77 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.974 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.73 -44.99 70.35 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.859 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.64 -35.38 80.63 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.871 179.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.5 tp -72.91 -38.37 66.92 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.145 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -62.28 -43.38 98.96 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.263 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.3 ptpt -69.23 -30.77 68.99 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.808 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.24 -39.4 94.49 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.294 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 21.6 mt -62.95 -40.89 90.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.838 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -55.82 -38.42 69.98 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.082 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 31.9 mm -68.77 -38.02 78.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.96 179.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.3 tp -62.28 -36.95 83.67 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.027 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.41 ' HA ' ' HG3' ' A' ' 72' ' ' MET . 14.6 t70 -57.9 -36.89 73.06 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.956 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 9.2 mtt-85 -65.74 -32.38 73.9 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.833 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 26.2 t -68.66 165.06 20.16 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.147 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.95 -37.73 38.85 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.861 -179.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.82 -69.75 0.27 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.649 -0.251 . . . . 0.0 111.483 -179.295 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.41 ' HG3' ' HA ' ' A' ' 67' ' ' ASP . 2.0 ttm 53.83 30.49 11.47 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 120.759 0.314 . . . . 0.0 111.422 -179.711 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.7 mmpt? -117.8 -31.25 5.19 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.687 -0.233 . . . . 0.0 111.28 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.2 p -126.53 165.57 18.88 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.928 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -113.5 122.25 46.7 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.626 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.2 mtt-85 -82.95 93.62 7.57 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 120.837 0.351 . . . . 0.0 110.762 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 17.2 mt -126.11 131.43 71.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.133 -179.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.8 tp -115.27 117.04 29.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.522 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.8 pp -110.57 135.41 51.25 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.768 0.318 . . . . 0.0 110.952 179.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.1 mt -135.74 154.14 51.34 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.677 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.4 ' CB ' HD21 ' A' ' 40' ' ' LEU . 6.2 t -89.67 145.07 25.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.984 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -88.23 6.0 38.9 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.412 ' O ' ' HB2' ' A' ' 84' ' ' ARG . 12.2 p30 -65.8 97.29 0.33 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.929 0.395 . . . . 0.0 111.632 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.412 ' HB2' ' O ' ' A' ' 83' ' ' ASP . 9.8 mmt85 69.4 117.44 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 122.889 0.475 . . . . 0.0 111.883 179.63 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -139.07 97.2 3.25 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.731 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -76.4 121.92 23.75 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.376 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -85.74 -71.9 0.51 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.393 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 17.1 p-80 -139.43 129.42 25.0 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.859 0.361 . . . . 0.0 110.998 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 15.6 p80 -99.37 -16.25 18.49 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.936 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.1 m80 66.32 164.08 0.18 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.64 0.257 . . . . 0.0 111.192 -179.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 2.4 t60 66.22 105.45 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.112 -179.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -141.83 151.96 43.24 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.19 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 9.6 p80 . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.134 -0.936 . . . . 0.0 111.081 179.801 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 . . . . . 0 N--CA 1.49 1.543 0 CA-C-O 120.665 0.269 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.3 m 63.51 167.69 0.14 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.314 -179.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 59.1 99.74 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.184 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.2 t -108.56 123.7 64.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.334 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.91 106.62 18.52 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.594 179.687 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 23.0 mt -107.09 124.69 63.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.123 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.6 116.98 33.96 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.764 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -104.27 139.92 38.59 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.943 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -123.37 132.25 53.91 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.95 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -142.12 117.05 9.92 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.786 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 57.97 35.62 25.44 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.335 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.06 -35.46 4.17 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.839 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -64.8 135.99 56.4 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.737 0.268 . . . . 0.0 110.932 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -117.35 140.18 49.9 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.22 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 25.1 mtt-85 -148.25 136.4 21.16 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.234 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.5 mt -105.14 125.04 60.24 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.233 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.418 HD13 HG23 ' A' ' 17' ' ' ILE . 26.0 mm -115.78 133.08 63.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.104 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.4 132.16 37.91 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.104 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -128.01 146.03 50.79 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.196 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.52 141.73 28.41 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.998 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.8 mtm180 -98.2 138.6 20.9 Favored Pre-proline 0 C--O 1.233 0.192 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.017 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -75.14 146.93 87.8 Favored 'Cis proline' 0 C--N 1.35 0.615 0 C-N-CA 123.773 -1.345 . . . . 0.0 112.446 0.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.4 p -117.56 121.03 66.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 120.918 0.39 . . . . 0.0 111.008 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.58 130.62 39.1 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.875 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -55.31 -35.76 65.48 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.983 179.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -60.72 -42.37 97.14 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.879 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -67.91 -43.12 79.96 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.919 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.2 t -61.96 -47.02 95.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.95 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' ' 30' ' ' HIS . 10.5 pt-20 -65.72 -42.27 91.26 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.927 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . 0.431 ' N ' ' HG3' ' A' ' 29' ' ' GLU . 0.8 OUTLIER -56.47 -42.48 78.3 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.233 -179.971 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.9 tttt -70.25 -49.16 52.72 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.051 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 24.4 t -63.19 -40.75 90.22 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.388 -179.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 60.3 m -58.56 -42.56 88.23 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.057 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.1 m -72.31 -35.29 68.61 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 120.484 0.183 . . . . 0.0 111.452 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 49.1 t -67.69 -50.71 58.13 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -179.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -103.97 10.92 36.01 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -179.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.63 172.4 9.39 Favored Glycine 0 CA--C 1.523 0.545 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.906 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -128.63 158.82 70.81 Favored Pre-proline 0 N--CA 1.463 0.213 0 CA-C-O 120.457 0.17 . . . . 0.0 110.709 179.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -87.57 153.88 41.46 Favored 'Cis proline' 0 C--N 1.35 0.638 0 C-N-CA 123.834 -1.319 . . . . 0.0 113.441 0.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 47.6 mt -138.93 155.69 47.84 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.703 179.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -114.54 134.12 55.27 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.842 0.353 . . . . 0.0 110.83 179.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.4 mp -91.39 103.75 16.35 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.943 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.41 ' CD2' ' HB2' ' A' ' 50' ' ' SER . 0.1 OUTLIER -111.15 122.18 47.22 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.337 -179.552 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.424 ' HB3' HD11 ' A' ' 53' ' ' LEU . 13.4 t80 -124.32 130.52 52.66 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.699 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.43 133.14 49.97 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.799 179.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -63.74 -56.23 17.21 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.735 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -157.43 -53.94 0.07 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.583 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -127.04 7.79 6.64 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.522 179.459 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.2 mt -131.39 138.65 49.21 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.474 0.178 . . . . 0.0 110.895 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.41 ' HB2' ' CD2' ' A' ' 43' ' ' HIS . 29.9 p -110.33 131.62 54.89 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.964 179.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 24.4 mt -130.28 134.62 62.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.974 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.8 133.55 33.98 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.925 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.424 HD11 ' HB3' ' A' ' 44' ' ' TYR . 0.2 OUTLIER -126.26 87.98 2.76 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.773 179.916 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -109.12 26.72 10.3 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.988 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -154.7 154.16 32.44 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.774 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.0 tp60 -60.55 -34.03 73.55 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.853 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -59.7 -50.63 73.12 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.02 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.05 -42.91 99.68 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.841 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 15.1 tp -60.93 -40.75 94.4 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.01 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.63 -41.53 97.61 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.908 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 15.6 mtpt -63.5 -36.84 85.08 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.77 -36.45 83.13 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.106 179.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 39.3 mt -60.16 -44.01 94.33 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.962 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -54.4 -41.31 69.13 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.967 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 46.2 mt -65.18 -46.21 91.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.019 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.1 mt -63.06 -39.35 94.47 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.914 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -57.99 -37.33 74.05 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.11 179.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.3 mmt180 -62.25 -35.13 78.01 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.206 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 33.1 t -88.76 112.19 22.89 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.123 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.2 m -72.6 -33.72 66.91 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.898 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.7 p -74.82 -37.08 62.4 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.491 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -90.37 111.92 23.33 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.085 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.6 pttt -126.41 32.17 5.24 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.932 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 61.4 p -146.64 153.64 40.54 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.121 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.5 mp -104.07 116.76 32.81 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.12 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 -90.17 91.86 8.71 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.698 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.8 mt -110.31 122.75 65.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.004 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -105.83 117.56 34.34 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.767 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.6 pp -109.38 133.22 53.33 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.788 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.1 pp -118.07 154.62 31.76 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.841 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 25.9 m -97.06 135.57 38.86 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.76 -179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.86 5.71 42.53 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.584 179.249 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.2 t70 64.31 39.98 6.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.259 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 6.4 mtp180 68.11 127.83 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.23 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -70.61 91.24 0.79 Allowed 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.797 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.54 124.03 23.76 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.92 -179.886 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -66.81 139.65 57.79 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.222 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -94.65 137.9 33.18 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.043 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.9 -173.71 3.99 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.969 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 38.5 t60 -97.44 145.18 26.44 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.228 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 72.59 -66.85 0.29 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.903 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -164.04 173.87 12.03 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.921 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.236 -0.887 . . . . 0.0 111.306 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 120.957 0.408 . . . . 0.0 111.469 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -153.29 160.67 42.78 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.263 179.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.403 ' OD1' ' HB3' ' A' ' 18' ' ' ALA . 3.7 t70 71.78 151.09 0.1 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.043 0.449 . . . . 0.0 111.207 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.4 t -128.32 137.77 56.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.152 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.55 116.08 28.49 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.432 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.416 HG21 ' CE2' ' A' ' 8' ' ' PHE . 4.0 mp -117.67 131.15 71.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.974 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 26.6 tttt -106.63 129.18 54.59 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.929 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.416 ' CE2' HG21 ' A' ' 6' ' ' ILE . 83.1 m-85 -114.73 134.41 55.12 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.881 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -119.21 123.85 45.33 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.962 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.4 t-160 -134.81 115.9 14.2 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.624 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 57.93 32.53 22.07 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.301 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 96.06 -34.77 4.72 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.995 -0.622 . . . . 0.0 112.699 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -65.02 136.41 56.75 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.703 0.287 . . . . 0.0 110.932 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 40.9 mtm-85 -108.61 138.78 44.36 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.158 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -132.81 127.83 35.39 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.798 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.8 mp -110.39 123.95 66.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.923 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 33.6 mt -137.44 131.81 44.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 121.029 0.442 . . . . 0.0 111.034 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.403 ' HB3' ' OD1' ' A' ' 3' ' ' ASP . . . -92.03 134.04 35.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.696 -0.683 . . . . 0.0 111.122 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 -116.21 119.26 35.2 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.767 179.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 93.2 p -74.9 131.18 40.51 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.912 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.3 mtm180 -73.95 151.78 88.6 Favored Pre-proline 0 N--CA 1.463 0.223 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.288 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.14 166.18 82.93 Favored 'Cis proline' 0 C--N 1.351 0.668 0 C-N-CA 123.562 -1.433 . . . . 0.0 112.845 0.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.5 p -152.63 153.17 9.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.239 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.31 164.17 28.01 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.491 -179.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -56.92 -44.65 82.66 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.264 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -58.09 -45.15 87.65 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.396 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -67.03 -44.42 80.28 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.572 -179.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 40.0 t -67.9 -46.99 81.01 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.065 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -63.45 -41.49 98.65 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.388 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.6 m80 -56.68 -40.89 76.37 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.641 0.258 . . . . 0.0 111.059 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.78 -49.07 56.44 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.257 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 46.4 t -65.39 -42.57 93.83 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 CA-C-N 116.693 -0.231 . . . . 0.0 111.516 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.424 HG22 ' HB3' ' A' ' 38' ' ' GLN . 75.0 m -59.06 -39.67 82.79 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.725 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 29.7 m -72.15 -32.47 66.92 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 121.247 -0.181 . . . . 0.0 111.331 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.4 t -66.87 -58.28 7.01 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 N-CA-C 111.435 0.161 . . . . 0.0 111.435 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.439 ' HB2' ' CD1' ' A' ' 40' ' ' LEU . 33.0 m-85 -95.85 6.78 48.07 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -179.157 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.09 -176.29 54.72 Favored Glycine 0 C--N 1.336 0.546 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.693 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.424 ' HB3' HG22 ' A' ' 33' ' ' THR . 0.4 OUTLIER -131.28 155.87 80.91 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 120.561 0.22 . . . . 0.0 111.068 -179.9 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -90.61 153.72 25.34 Favored 'Cis proline' 0 C--N 1.349 0.601 0 C-N-CA 123.744 -1.357 . . . . 0.0 113.273 0.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.439 ' CD1' ' HB2' ' A' ' 36' ' ' PHE . 21.5 mt -137.41 141.79 41.67 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.933 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -114.33 127.63 55.95 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.936 179.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 21.0 mt -92.66 112.84 24.94 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.829 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.423 ' CD2' HD11 ' A' ' 52' ' ' LEU . 10.0 t-160 -110.54 120.65 43.11 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.156 -179.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.434 ' HB2' ' CD2' ' A' ' 53' ' ' LEU . 1.2 t80 -88.76 130.33 35.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.842 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.6 mpp? -126.93 113.96 17.21 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.547 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -72.77 -53.98 10.13 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.733 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -176.68 -56.62 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.343 179.78 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -107.21 -26.79 10.91 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.536 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -114.04 155.61 25.62 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.882 0.372 . . . . 0.0 111.495 -179.576 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -118.12 124.94 49.25 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.839 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 9.6 mt -113.87 133.12 60.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.046 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.423 HD11 ' CD2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -96.84 135.87 38.2 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.806 179.825 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.434 ' CD2' ' HB2' ' A' ' 44' ' ' TYR . 1.0 OUTLIER -95.33 76.68 3.4 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.617 179.915 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 3.0 pttp -77.37 -35.34 54.59 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.489 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -123.14 165.06 17.48 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.075 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.8 tm0? -59.94 -35.86 75.82 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.807 179.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -53.81 -49.88 67.37 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.91 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -59.17 -46.0 89.55 Favored 'General case' 0 N--CA 1.461 0.125 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.148 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.3 tp -66.15 -41.86 89.83 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.885 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -66.27 -42.34 88.62 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.395 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -62.75 -36.52 83.31 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.45 179.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.81 -39.14 93.52 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.205 179.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.2 mt -64.53 -42.78 96.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.798 179.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.11 -37.69 67.18 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.945 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 9.5 mt -65.86 -41.69 90.6 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.879 179.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 5.9 tt -61.42 -44.21 97.53 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.865 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.79 -34.41 78.28 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.076 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -67.32 -32.63 73.72 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.406 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.7 t -103.92 109.05 20.66 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.294 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 47.5 t -77.7 -9.17 58.84 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.3 p -89.65 42.53 1.1 Allowed 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 120.758 0.313 . . . . 0.0 111.66 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.81 -173.67 3.63 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.691 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.7 mttm -130.87 -69.05 0.66 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.652 0.263 . . . . 0.0 111.012 179.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -130.52 -173.01 2.95 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.058 -179.677 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.9 mp -91.9 121.54 33.59 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.452 179.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.9 tpt180 -76.81 80.34 3.41 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.002 0.429 . . . . 0.0 110.74 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.5 mt -103.93 123.24 57.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.754 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -103.29 117.29 34.17 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.819 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.1 pp -105.7 127.77 53.27 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.568 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.3 mp -119.82 127.62 52.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.127 -179.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -98.2 131.17 44.78 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.986 179.616 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.1 5.28 47.49 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.49 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -110.37 127.62 55.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.699 -179.753 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.51 92.26 4.0 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.843 0.354 . . . . 0.0 110.864 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -125.56 -177.87 4.05 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.829 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 64.66 48.19 2.63 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.054 0.454 . . . . 0.0 110.882 -179.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -78.27 -45.11 23.67 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.826 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -164.62 175.18 10.03 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.623 179.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -85.02 -43.65 13.76 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.819 179.703 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER 63.0 -173.89 0.15 Allowed 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.228 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 9.8 p80 -106.1 29.18 6.96 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.103 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 21.4 p80 -168.57 133.59 1.67 Allowed 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.974 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.219 -0.896 . . . . 0.0 111.585 -179.95 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 121.039 0.447 . . . . 0.0 111.105 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.9 m -150.82 171.51 17.1 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.602 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -63.05 104.44 0.57 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.901 0.381 . . . . 0.0 110.87 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 23.2 t -78.48 130.08 36.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.348 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -87.76 123.58 32.71 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.928 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 3.1 mt -118.06 124.53 73.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.643 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.7 mttp -95.07 121.24 36.5 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.796 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -113.15 131.72 55.74 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.689 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -119.22 127.91 53.71 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.182 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 12.9 t-160 -130.98 117.19 18.84 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.522 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 56.33 32.27 20.16 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.548 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 96.26 -28.08 14.43 Favored Glycine 0 C--N 1.335 0.508 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.012 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.5 148.19 52.15 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.829 0.347 . . . . 0.0 111.273 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.7 ptp85 -109.07 142.59 39.56 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.113 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -141.87 139.95 32.76 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.227 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.1 mp -115.38 131.72 66.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.233 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.405 HD13 HG22 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -145.34 131.38 14.15 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.237 -179.944 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -103.88 127.68 51.38 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.059 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -113.28 120.7 42.09 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.087 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.3 m -82.55 128.53 34.39 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.931 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.0 mtm180 -78.33 156.8 78.53 Favored Pre-proline 0 N--CA 1.464 0.233 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.912 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.68 126.37 12.89 Favored 'Cis proline' 0 C--N 1.351 0.667 0 C-N-CA 123.566 -1.431 . . . . 0.0 112.667 -0.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.1 p -103.25 147.05 10.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.454 -179.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.66 146.11 36.77 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.109 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -59.68 -39.6 85.04 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.629 179.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -43.83 98.14 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.837 179.682 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -64.96 -44.34 89.7 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.425 -179.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 43.1 t -68.18 -47.3 78.89 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.125 0 CA-C-O 120.605 0.24 . . . . 0.0 111.156 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -64.28 -45.45 87.98 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.136 -179.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -58.95 -44.36 91.43 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.752 0.31 . . . . 0.0 110.596 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.2 tttt -64.05 -49.47 72.23 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.228 179.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 43.6 t -64.09 -41.05 91.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-N 116.764 -0.198 . . . . 0.0 111.323 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 95.9 m -61.34 -39.5 90.79 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.993 179.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.3 m -72.42 -40.97 66.73 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 121.137 -0.225 . . . . 0.0 111.344 179.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.3 t -64.84 -55.1 22.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.173 0 CA-C-O 120.67 0.271 . . . . 0.0 111.353 -179.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -85.95 -7.45 58.66 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -179.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.03 177.15 50.01 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.571 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.94 154.43 79.22 Favored Pre-proline 0 N--CA 1.465 0.301 0 CA-C-O 120.571 0.224 . . . . 0.0 111.044 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -86.91 153.52 45.12 Favored 'Cis proline' 0 C--N 1.349 0.59 0 C-N-CA 123.655 -1.394 . . . . 0.0 113.449 0.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 32.6 mt -138.38 157.1 46.89 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.923 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -114.43 118.44 33.83 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.002 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 37.5 mt -79.84 100.1 7.84 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.892 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.4 m170 -103.73 112.26 25.13 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.874 0.369 . . . . 0.0 111.247 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -94.96 115.89 28.02 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.23 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.3 ttm -101.84 124.95 48.34 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.986 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -79.56 -41.1 27.95 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.712 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -171.81 -64.17 0.02 OUTLIER 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.334 179.675 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.81 -29.49 7.95 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.576 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -107.2 155.3 20.05 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.852 0.358 . . . . 0.0 111.291 -179.42 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.6 t -114.81 132.95 56.31 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.983 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 28.9 mt -125.39 134.34 67.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.694 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.5 tt -83.14 132.71 35.07 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.652 0.263 . . . . 0.0 111.093 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.1 mt -87.27 110.67 20.36 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.64 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.07 -64.06 1.18 Allowed 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.45 -179.545 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -136.13 -169.04 2.34 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.82 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -54.12 -30.77 50.1 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -54.14 -42.31 69.38 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.62 0.247 . . . . 0.0 111.119 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.42 -48.46 69.96 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.806 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.3 tt -64.23 -39.63 94.37 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.201 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -61.81 -43.28 99.16 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.746 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.19 -36.33 83.7 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.643 179.311 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.68 -38.95 92.38 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.327 179.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 13.6 mt -64.35 -44.4 97.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.8 0.333 . . . . 0.0 110.642 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -56.48 -42.82 78.9 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.053 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 27.2 mt -69.19 -38.33 77.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.805 179.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 9.6 tp -60.5 -46.0 91.72 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.865 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -60.61 -36.15 77.87 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.718 179.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.6 ttm-85 -63.15 -33.0 74.52 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.28 179.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 31.1 t -72.3 150.9 43.14 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 120.664 0.269 . . . . 0.0 111.219 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 4.4 m -81.03 -33.04 33.86 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.493 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.0 p -74.07 -69.22 0.46 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.67 -0.241 . . . . 0.0 111.532 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.7 ttt 54.14 81.41 0.1 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.872 0.368 . . . . 0.0 111.016 -179.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.6 ptpt -128.78 85.63 2.35 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.001 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.5 t 66.06 -179.83 0.2 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.384 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.7 mp -109.49 131.55 54.96 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.114 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.7 mtt85 -87.64 88.15 7.59 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.993 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.445 HD11 HG23 ' A' ' 77' ' ' ILE . 23.1 mt -122.39 127.31 75.06 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.132 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.931 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -116.62 117.43 29.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.858 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.9 pp -96.2 127.97 42.69 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.804 0.335 . . . . 0.0 110.764 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.3 mp -112.79 147.51 36.76 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.353 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.3 p -95.1 147.47 23.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.824 179.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -85.47 5.46 31.12 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.227 -0.442 . . . . 0.0 112.03 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.72 70.89 3.52 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.922 0.392 . . . . 0.0 110.596 179.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 51.0 mtt180 -129.37 103.2 6.79 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.697 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -86.92 -70.19 0.63 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.099 -179.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.79 -31.84 69.97 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.809 179.747 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -79.27 98.5 6.68 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.197 -179.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -169.16 42.18 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.529 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -174.2 158.65 3.04 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.485 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -171.19 -53.12 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.653 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -166.76 133.58 2.44 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.399 179.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 45.9 t-80 68.64 107.8 0.05 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.499 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 16.6 p80 . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.517 -0.754 . . . . 0.0 111.13 179.376 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.709 0 CA-C-O 120.548 0.213 . . . . 0.0 111.529 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.9 m 65.88 159.84 0.13 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.456 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 65.34 116.08 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.145 -179.706 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 15.4 t -106.3 128.98 60.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.336 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -86.88 115.85 24.56 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.676 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 20.1 mm -104.74 125.69 59.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.134 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.8 ttmt -100.92 116.15 32.11 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.636 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -109.55 132.61 53.97 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.717 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -119.51 133.61 55.6 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.196 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -141.11 116.11 9.84 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.81 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 34.8 m-20 56.05 35.66 25.99 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.339 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.45 -27.93 12.44 Favored Glycine 0 CA--C 1.525 0.677 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.963 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.55 150.16 47.35 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.715 0.257 . . . . 0.0 111.145 179.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.6 mtm-85 -125.75 143.82 50.89 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.397 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.23 132.36 16.34 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.165 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.5 mt -109.3 122.97 64.79 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.742 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 26.4 mt -133.08 130.18 57.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.122 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -97.54 131.18 44.38 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.098 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -112.96 117.04 30.97 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.745 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.85 140.1 47.37 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.846 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.47 150.91 95.68 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.978 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.74 132.44 26.91 Favored 'Cis proline' 0 C--N 1.35 0.606 0 C-N-CA 123.298 -1.543 . . . . 0.0 112.731 0.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.6 p -89.64 124.43 42.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.718 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 6.4 mttt -113.21 134.47 54.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.941 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -56.54 -46.46 80.65 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.076 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.22 -44.91 88.43 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.025 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -65.12 -44.67 87.96 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.304 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 45.4 t -67.71 -47.26 80.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.777 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -59.71 -44.29 93.78 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.653 179.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 3.7 t60 -57.89 -38.91 76.66 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.239 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.82 -49.96 47.58 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.799 -0.182 . . . . 0.0 111.099 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.8 t -67.49 -43.33 87.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.9 t -59.8 -39.1 83.84 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.526 -179.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.3 m -72.12 -39.9 68.52 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 111.474 0.176 . . . . 0.0 111.474 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.8 t -60.66 -55.75 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 120.508 0.194 . . . . 0.0 111.314 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -84.6 -20.06 32.04 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -179.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.4 178.22 41.38 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.6 -179.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -126.38 160.2 59.08 Favored Pre-proline 0 CA--C 1.53 0.201 0 CA-C-O 120.586 0.232 . . . . 0.0 110.85 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -83.82 146.34 52.36 Favored 'Cis proline' 0 C--N 1.351 0.686 0 C-N-CA 123.521 -1.45 . . . . 0.0 113.221 0.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 17.3 mt -137.52 146.58 44.35 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.918 179.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -116.35 134.51 54.81 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.165 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.33 114.51 27.06 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.876 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -114.3 111.58 21.72 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.073 -179.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 16.8 t80 -93.4 121.9 35.26 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.276 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.1 ptt? -123.98 132.2 53.67 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.843 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -97.51 -47.89 5.49 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.358 179.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -163.72 -71.32 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.26 179.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -109.85 -25.72 10.17 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.453 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -103.6 140.74 37.14 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.76 0.314 . . . . 0.0 111.256 -179.607 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.3 m -112.37 132.25 55.11 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.698 179.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.41 HG23 HD13 ' A' ' 51' ' ' ILE . 30.0 mm -114.54 133.87 59.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.774 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.21 120.71 32.36 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.853 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 40.5 mt -104.61 125.27 50.58 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.57 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.2 ttmp? -128.5 -55.73 1.24 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.971 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.4 m-20 -104.53 174.58 5.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.792 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -58.98 -33.9 71.2 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.944 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.95 -48.53 67.28 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 120.579 0.228 . . . . 0.0 111.279 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -63.26 -47.19 83.4 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.564 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 20.5 tp -63.43 -40.23 96.61 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.44 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -61.48 -43.3 99.1 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.607 -0.27 . . . . 0.0 110.813 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -34.72 78.76 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.814 179.291 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.99 -35.23 79.52 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.138 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 31.3 mm -59.64 -46.52 93.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.473 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -53.16 -43.51 67.09 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.849 179.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 32.3 mt -65.24 -43.15 95.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.311 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.24 -48.09 62.85 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.886 0.374 . . . . 0.0 110.728 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.03 -40.33 76.52 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.6 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 37.3 ptt85 -69.02 -29.7 67.93 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 111.58 0.215 . . . . 0.0 111.58 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 64.7 p -76.12 116.75 17.13 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 120.732 0.301 . . . . 0.0 110.828 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 50.5 p -74.4 -48.97 24.49 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.246 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.17 -48.06 77.45 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.283 -179.622 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.06 145.64 49.77 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.016 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.9 mttp -136.66 -51.93 0.69 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.074 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.1 166.1 21.01 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.886 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -101.05 126.67 47.75 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.182 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.0 mtt180 -93.33 81.99 4.46 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.05 0.453 . . . . 0.0 110.851 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.3 mt -107.27 114.16 45.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.558 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.81 117.05 34.04 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.54 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -104.72 135.89 45.26 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.881 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -139.97 154.7 47.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.83 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 60.5 m -70.73 142.96 51.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.079 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.93 5.57 32.47 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 179.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.44 56.95 4.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.084 0.468 . . . . 0.0 110.929 179.543 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -102.12 -40.73 6.69 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.48 179.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -165.16 -68.01 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.904 179.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.4 mp 60.97 171.31 0.1 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.969 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -172.55 -51.78 0.02 OUTLIER 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.735 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -159.0 84.1 0.8 Allowed 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.245 179.717 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -114.29 -43.64 3.19 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.41 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -86.29 50.78 2.06 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 120.846 0.355 . . . . 0.0 111.106 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -163.04 35.9 0.1 Allowed 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.391 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -126.62 96.89 4.81 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.601 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.579 -0.724 . . . . 0.0 111.252 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.4 t0 . . . . . 0 N--CA 1.465 0.309 0 CA-C-O 120.842 0.353 . . . . 0.0 111.055 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.9 t -94.91 116.37 36.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.269 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -87.25 115.42 24.63 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.735 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.512 HG12 HD13 ' A' ' 75' ' ' LEU . 22.7 mt -114.25 126.47 71.77 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.933 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.9 mtpt -100.65 115.45 30.24 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.873 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -101.58 138.93 37.93 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.025 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -122.44 128.17 50.55 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.962 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 25.2 t-80 -142.86 112.02 6.6 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.57 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 59.21 34.06 22.95 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.114 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.73 -31.01 6.82 Favored Glycine 0 CA--C 1.524 0.602 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.815 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -65.41 142.99 58.0 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.873 0.368 . . . . 0.0 111.151 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -119.71 143.55 47.71 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.362 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.92 134.89 30.65 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.948 179.617 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 22.1 mt -105.77 118.17 52.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.88 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.8 mt -128.33 129.9 69.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.179 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.46 147.44 23.54 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.2 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.402 ' CD2' HD12 ' A' ' 6' ' ' ILE . 13.0 m-85 -130.38 138.8 50.56 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.287 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.5 p -94.98 119.83 34.16 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.948 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.5 mtt180 -68.61 150.32 97.7 Favored Pre-proline 0 N--CA 1.464 0.254 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.893 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -72.72 144.43 80.77 Favored 'Cis proline' 0 C--N 1.35 0.623 0 C-N-CA 123.776 -1.343 . . . . 0.0 112.425 0.114 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.3 p -113.2 123.61 69.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.027 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.608 ' O ' HG23 ' A' ' 28' ' ' VAL . 3.7 mptt -101.01 137.52 39.27 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.048 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.713 ' HB2' HD22 ' A' ' 59' ' ' LEU . 66.0 t80 -54.78 -40.36 69.35 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.036 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -63.19 -45.31 92.34 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.973 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -64.37 -44.41 91.47 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.131 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.608 HG23 ' O ' ' A' ' 24' ' ' LYS . 26.3 t -62.46 -46.8 95.53 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.663 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.05 -46.07 85.97 Favored 'General case' 0 CA--C 1.528 0.111 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.038 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.05 -42.07 79.87 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 120.6 0.238 . . . . 0.0 111.246 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.787 ' O ' HG23 ' A' ' 35' ' ' VAL . 38.9 tttp -71.1 -49.8 40.47 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.25 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 28' ' ' VAL . 39.6 t -64.82 -41.53 92.42 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.765 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 54.9 m -58.81 -39.43 81.14 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.905 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.4 m -71.91 -36.81 70.09 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 121.369 -0.132 . . . . 0.0 111.258 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.787 HG23 ' O ' ' A' ' 31' ' ' LYS . 42.3 t -61.21 -55.18 26.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 N-CA-C 111.541 0.2 . . . . 0.0 111.541 -179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.641 ' CE2' HD21 ' A' ' 79' ' ' LEU . 71.4 m-85 -89.96 -19.68 24.21 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -178.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.431 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 105.07 179.24 24.24 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.301 -179.464 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -139.92 154.17 70.35 Favored Pre-proline 0 N--CA 1.464 0.271 0 O-C-N 122.819 -0.224 . . . . 0.0 110.914 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -85.84 148.73 44.04 Favored 'Cis proline' 0 C--N 1.351 0.684 0 C-N-CA 123.607 -1.414 . . . . 0.0 113.207 0.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.658 HD23 ' HA ' ' A' ' 81' ' ' SER . 20.0 mt -138.74 158.59 43.95 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.03 179.758 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -113.3 140.35 48.07 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.002 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.473 ' O ' HD13 ' A' ' 52' ' ' LEU . 12.9 mt -102.75 107.08 17.84 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.196 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -104.03 125.65 50.55 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.128 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -114.53 130.3 56.74 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.408 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 9.4 ptp -128.62 122.16 30.28 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.853 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -79.91 -59.7 2.63 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.462 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -175.03 -55.75 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.463 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -106.8 -26.32 11.32 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.551 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.3 mt -123.36 145.68 48.55 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.715 0.293 . . . . 0.0 111.248 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 56.1 p -120.82 132.78 55.2 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.811 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mp -126.94 132.53 69.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.972 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.473 HD13 ' O ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -85.33 118.98 25.2 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.323 179.783 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 26.8 mt -65.89 105.73 1.38 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.945 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.0 mttp -110.88 -35.82 5.85 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.222 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -136.47 171.91 13.79 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.105 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -58.2 -29.94 66.07 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.119 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.438 ' HA ' ' OD2' ' A' ' 60' ' ' ASP . 1.2 m-20 -56.26 -43.5 78.79 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.116 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -66.89 -32.22 73.34 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.799 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.713 HD22 ' HB2' ' A' ' 25' ' ' TYR . 33.1 tp -64.86 -45.44 86.08 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.726 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.438 ' OD2' ' HA ' ' A' ' 57' ' ' ASP . 2.5 p30 -70.56 -31.85 69.03 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.577 0.227 . . . . 0.0 110.975 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -38.02 89.06 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.713 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.43 -42.98 86.92 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.2 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.3 mm -66.34 -41.69 89.36 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.156 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -55.15 -45.46 75.67 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.192 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.6 mt -66.57 -39.27 83.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.813 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 20.0 tp -64.56 -43.67 93.2 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.877 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -57.16 -42.68 81.55 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.069 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.71 -31.95 72.96 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.073 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 27.5 t -79.03 146.18 33.46 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.128 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.63 -18.75 62.18 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.541 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 60.3 p -93.57 38.2 1.06 Allowed 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.756 0.312 . . . . 0.0 111.554 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.35 84.71 4.51 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.639 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp -138.93 -58.99 0.6 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.929 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.1 p -112.99 168.22 9.87 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.041 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.512 HD13 HG12 ' A' ' 6' ' ' ILE . 5.5 mp -122.62 138.81 54.48 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.038 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 7.4 ttp180 -97.31 87.57 4.19 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.982 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.1 mt -117.68 118.2 57.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.691 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.3 tt -108.52 128.65 54.99 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.178 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.641 HD21 ' CE2' ' A' ' 36' ' ' PHE . 3.5 pp -113.76 136.61 52.67 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.846 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -135.6 148.19 48.95 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.163 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' SER . . . . . 0.658 ' HA ' HD23 ' A' ' 40' ' ' LEU . 2.6 p -72.65 147.39 45.81 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.391 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 . . . . . 0 CA--C 1.535 0.369 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -179.556 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.6 t0 . . . . . 0 C--O 1.235 0.3 0 CA-C-O 120.677 0.275 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 22.2 t -96.08 123.19 48.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.888 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.7 mtt180 -87.29 114.81 24.23 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.951 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.491 HG21 HD12 ' A' ' 77' ' ' ILE . 23.7 mt -105.9 118.51 53.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.827 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -103.65 114.7 29.16 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.363 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.513 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 0.9 OUTLIER -117.6 145.53 44.25 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.921 -179.774 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -119.21 139.88 51.12 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.615 -179.477 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' HIS . . . . . 0.52 ' HB2' HD11 ' A' ' 79' ' ' LEU . 24.5 t-80 -141.02 114.65 8.89 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.364 179.592 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 51.3 m-20 57.63 33.47 23.29 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.657 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.14 -47.0 1.14 Allowed Glycine 0 C--N 1.336 0.545 0 C-N-CA 120.863 -0.684 . . . . 0.0 113.36 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.24 145.39 51.39 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.815 0.34 . . . . 0.0 110.997 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 ptp180 -124.1 147.66 47.74 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.622 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.513 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -131.02 137.33 49.14 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.749 179.641 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 19.1 mt -117.41 126.32 74.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.908 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 28.0 mt -138.98 131.6 37.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.957 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.37 145.73 24.72 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.179 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -131.13 125.36 32.89 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.116 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.7 t -71.39 126.68 30.29 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.007 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 25.6 mtt85 -71.6 144.91 89.3 Favored Pre-proline 0 CA--C 1.53 0.192 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.031 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -77.38 123.12 9.2 Favored 'Cis proline' 0 C--N 1.349 0.581 0 C-N-CA 123.193 -1.586 . . . . 0.0 112.612 -0.084 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.3 p -72.27 145.4 12.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.058 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.576 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.5 mmmt -111.38 132.28 54.55 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.259 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.401 ' HD1' HD13 ' A' ' 59' ' ' LEU . 64.4 t80 -57.46 -43.29 83.88 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.895 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -59.19 -43.56 92.21 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.167 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.402 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -65.7 -44.57 85.74 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.346 -179.955 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.576 HG23 ' O ' ' A' ' 24' ' ' LYS . 23.7 t -65.39 -47.97 84.9 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.738 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.51 ' HG2' HD11 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -63.67 -46.14 86.92 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.345 179.912 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 67.2 t60 -56.38 -41.01 75.51 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.535 0.207 . . . . 0.0 111.443 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.78 ' O ' HG23 ' A' ' 35' ' ' VAL . 8.4 tttp -71.05 -49.79 40.97 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.341 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 28' ' ' VAL . 46.5 t -66.4 -43.01 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.602 -179.555 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 53.4 m -59.05 -39.24 81.42 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.314 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.5 m -72.2 -36.69 69.26 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.399 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.78 HG23 ' O ' ' A' ' 31' ' ' LYS . 57.0 t -62.34 -51.6 70.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.544 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -95.59 -18.09 20.85 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -178.691 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.679 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 105.93 -177.51 22.58 Favored Glycine 0 CA--C 1.523 0.557 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.599 -179.391 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.411 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 7.6 pm0 -134.08 155.43 80.07 Favored Pre-proline 0 N--CA 1.463 0.219 0 O-C-N 122.776 -0.249 . . . . 0.0 111.098 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.411 ' HA ' ' HB2' ' A' ' 38' ' ' GLN . 83.4 Cg_endo -90.0 145.1 17.82 Favored 'Cis proline' 0 C--N 1.348 0.508 0 C-N-CA 123.651 -1.396 . . . . 0.0 113.101 0.233 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.679 HD12 ' O ' ' A' ' 37' ' ' GLY . 23.2 mt -138.49 139.87 38.96 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.831 179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -112.4 140.28 47.27 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.092 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.51 HD11 ' HG2' ' A' ' 29' ' ' GLU . 3.7 mt -87.45 113.97 23.63 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.036 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -106.04 117.54 34.28 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.014 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.403 ' HB3' HD23 ' A' ' 53' ' ' LEU . 14.2 t80 -107.17 122.84 47.31 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 120.783 0.325 . . . . 0.0 110.697 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 28.2 mtp -110.62 128.17 55.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.431 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -71.3 -56.42 6.05 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.711 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -178.86 -52.99 0.01 OUTLIER 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.329 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -104.73 -29.73 10.38 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.53 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -119.68 160.35 22.69 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.876 0.37 . . . . 0.0 111.522 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.5 m -104.64 132.33 51.02 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.988 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 25.1 mm -116.02 133.45 62.44 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.916 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.0 mt -104.4 125.15 50.35 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.89 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.403 HD23 ' HB3' ' A' ' 44' ' ' TYR . 0.9 OUTLIER -119.59 106.13 11.88 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.398 179.924 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -107.77 -34.43 6.97 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.137 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -98.23 166.11 11.56 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.626 0.25 . . . . 0.0 110.825 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.06 -35.64 80.93 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.04 179.428 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -52.84 -47.05 68.02 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.141 179.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.4 -31.66 72.56 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.177 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.401 HD13 ' HD1' ' A' ' 25' ' ' TYR . 6.0 tp -72.69 -39.03 67.34 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.68 -0.236 . . . . 0.0 110.552 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.86 -43.5 98.71 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.268 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -66.63 -38.84 87.77 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.818 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.31 -45.0 93.38 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.562 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 14.1 mt -66.37 -41.13 88.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.894 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -55.08 -44.96 75.33 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.039 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.3 mt -64.82 -43.11 96.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.733 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.753 HD12 ' HB3' ' A' ' 72' ' ' MET . 9.2 tp -62.01 -47.3 85.39 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.129 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.97 -37.49 87.84 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.246 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -72.61 -35.27 67.82 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.069 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.0 t -76.39 128.26 34.47 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.39 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 27.9 p -75.09 -38.43 61.22 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.826 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.74 -47.16 32.74 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.171 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.753 ' HB3' HD12 ' A' ' 66' ' ' LEU . 1.8 mpp? -78.79 91.76 4.76 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.113 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.9 mtpt -97.0 -45.81 6.44 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.184 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.465 ' O ' HD11 ' A' ' 66' ' ' LEU . 2.8 p -91.0 151.2 21.15 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.902 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.699 ' HG ' HD22 ' A' ' 66' ' ' LEU . 0.2 OUTLIER -91.98 124.15 35.87 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.01 -179.955 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -93.68 88.9 6.0 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.878 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.491 HD12 HG21 ' A' ' 6' ' ' ILE . 31.1 mt -111.93 117.66 55.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.583 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.589 HD23 HD11 ' A' ' 80' ' ' LEU . 4.9 tp -102.06 123.69 46.37 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.852 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.52 HD11 ' HB2' ' A' ' 10' ' ' HIS . 2.3 pp -112.07 130.99 55.7 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.778 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.589 HD11 HD23 ' A' ' 78' ' ' LEU . 0.4 OUTLIER -131.5 142.69 50.01 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.988 -179.439 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.51 143.79 27.55 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.859 179.299 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.235 0.305 0 CA-C-N 115.971 -0.558 . . . . 0.0 112.1 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 p30 . . . . . 0 N--CA 1.464 0.243 0 CA-C-O 121.162 0.506 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 23.1 t -90.42 116.38 31.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.926 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.6 mtt180 -90.06 121.79 32.46 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.744 0.307 . . . . 0.0 111.049 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.534 HG23 ' HB2' ' A' ' 75' ' ' LEU . 2.6 mt -115.57 130.06 70.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.989 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.4 tttm -95.45 126.89 41.06 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.699 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -117.1 136.25 53.14 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.282 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.728 ' HB3' HD12 ' A' ' 78' ' ' LEU . 1.6 mt-10 -121.96 127.54 50.47 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.074 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.6 t-80 -131.13 112.57 12.98 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.686 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 55.67 34.76 23.92 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.523 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 98.69 -35.42 4.64 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.686 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.79 136.58 57.07 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.716 0.293 . . . . 0.0 110.817 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.13 145.29 41.19 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.621 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.63 130.2 13.97 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.087 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.9 mp -102.49 125.8 56.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.808 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.6 mt -130.38 134.29 62.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.219 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.27 138.8 31.22 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.248 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.492 ' CD1' HD12 ' A' ' 6' ' ' ILE . 38.5 m-85 -130.78 117.4 19.32 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.76 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.1 m -76.85 143.34 39.77 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.728 0.299 . . . . 0.0 111.188 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.5 mtm105 -96.05 154.98 38.75 Favored Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.125 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -73.12 142.44 74.76 Favored 'Cis proline' 0 C--N 1.349 0.597 0 C-N-CA 123.57 -1.429 . . . . 0.0 112.335 -0.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.5 p -128.41 147.58 32.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.944 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.483 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -115.97 143.96 44.73 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.007 -179.875 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.554 ' OH ' HD12 ' A' ' 42' ' ' LEU . 64.3 t80 -56.52 -36.95 69.8 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.285 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.87 -44.93 91.19 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.9 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.44 ' HB2' ' HG2' ' A' ' 24' ' ' LYS . 8.7 t0 -69.63 -44.3 70.9 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.007 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.689 ' O ' HG23 ' A' ' 32' ' ' VAL . 38.7 t -64.52 -46.16 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.866 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -58.65 -42.19 87.81 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.286 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -57.42 -46.1 83.88 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.742 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.714 ' O ' HG23 ' A' ' 35' ' ' VAL . 18.5 tttp -70.18 -48.78 55.77 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.943 179.673 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.689 HG23 ' O ' ' A' ' 28' ' ' VAL . 44.4 t -58.81 -42.37 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-N 116.76 -0.2 . . . . 0.0 111.318 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 86.4 m -64.19 -39.58 94.3 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.056 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 60.1 m -72.47 -42.72 64.63 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.449 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.714 HG23 ' O ' ' A' ' 31' ' ' LYS . 57.5 t -61.98 -51.37 73.34 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.405 ' CE2' HD21 ' A' ' 79' ' ' LEU . 41.7 m-85 -87.81 -20.95 25.39 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -179.204 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.405 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 103.49 -175.72 23.76 Favored Glycine 0 C--N 1.337 0.631 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.676 -179.615 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -144.32 155.46 57.73 Favored Pre-proline 0 N--CA 1.465 0.316 0 CA-C-O 120.528 0.204 . . . . 0.0 111.01 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -84.09 137.63 28.16 Favored 'Cis proline' 0 C--N 1.35 0.641 0 C-N-CA 123.546 -1.439 . . . . 0.0 113.205 0.316 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.687 HD23 ' HA ' ' A' ' 81' ' ' SER . 97.8 mt -137.18 130.41 31.02 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.744 179.488 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -105.09 139.86 39.13 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.729 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.622 HD23 ' HB3' ' A' ' 79' ' ' LEU . 64.7 mt -92.16 108.53 20.01 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.808 0.337 . . . . 0.0 110.94 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -109.36 117.74 34.83 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.495 -179.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.745 ' HB2' HD11 ' A' ' 53' ' ' LEU . 12.4 t80 -96.1 124.52 40.14 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.392 179.569 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 53.4 mtp -117.56 125.87 51.57 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.542 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.1 t30 -87.48 -52.61 5.26 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.777 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -173.58 -62.55 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.369 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -108.82 -25.55 10.73 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.565 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -111.93 149.33 32.07 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.823 0.344 . . . . 0.0 111.147 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.6 m -113.22 131.15 56.01 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.978 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.8 mt -121.63 133.99 66.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.909 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.9 mp -105.34 124.65 49.9 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.709 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.745 HD11 ' HB2' ' A' ' 44' ' ' TYR . 1.2 mp -91.81 92.61 8.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.721 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 42.8 mttm -111.17 30.44 6.9 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.134 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -175.97 167.39 3.02 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.912 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -63.13 -38.95 93.22 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.311 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.36 -44.45 80.14 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.338 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -64.78 -46.16 83.27 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.001 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 33.0 tp -61.26 -41.25 96.58 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.664 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -61.17 -43.09 99.43 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.575 179.54 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.3 mttm -65.31 -38.67 90.92 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.011 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.54 -41.35 98.82 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.015 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 18.8 mt -64.9 -43.84 96.25 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.081 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.662 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.67 -45.06 73.83 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.206 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 41.5 mt -68.36 -45.24 82.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.353 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.628 ' C ' HD13 ' A' ' 66' ' ' LEU . 1.5 tm? -65.92 -48.05 72.7 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.041 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.401 ' N ' HD13 ' A' ' 66' ' ' LEU . 1.9 t70 -60.2 -41.77 93.67 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.296 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -74.15 -31.65 62.81 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.66 -179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 76.9 p -80.91 112.07 17.96 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.6 0.238 . . . . 0.0 110.663 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 53.0 m -71.43 -30.32 65.91 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.062 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.16 -34.09 71.68 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.587 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 5.9 ttm -111.61 140.97 45.79 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.649 0.261 . . . . 0.0 111.053 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.4 mttt -115.46 -44.36 2.98 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.118 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 67.5 m -100.46 170.98 8.03 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.745 179.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.534 ' HB2' HG23 ' A' ' 6' ' ' ILE . 0.7 OUTLIER -91.87 120.6 32.71 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.786 179.941 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.0 mmt85 -91.76 73.98 5.78 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.537 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 36.0 mt -111.34 124.71 68.37 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.833 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.728 HD12 ' HB3' ' A' ' 9' ' ' GLU . 4.9 tp -102.08 119.63 39.11 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.863 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.622 ' HB3' HD23 ' A' ' 42' ' ' LEU . 2.0 pp -106.86 125.07 50.53 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.888 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.435 ' O ' HD12 ' A' ' 80' ' ' LEU . 1.0 OUTLIER -116.8 162.75 17.21 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.282 179.941 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 81' ' ' SER . . . . . 0.687 ' HA ' HD23 ' A' ' 40' ' ' LEU . 40.6 t -88.21 137.4 32.36 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.993 179.809 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 10.8 tp60 . . . . . 0 CA--C 1.533 0.291 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.687 179.373 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.412 0 CA-C-O 120.967 0.413 . . . . 0.0 111.205 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.8 t -86.06 110.48 19.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.982 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.26 108.8 19.11 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.688 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 19.5 mt -109.54 128.45 65.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.837 0.351 . . . . 0.0 111.44 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -101.35 123.4 45.38 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.828 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.619 ' CZ ' HG21 ' A' ' 32' ' ' VAL . 84.7 m-85 -115.03 139.88 49.51 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.041 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -124.26 125.44 44.39 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.959 0.409 . . . . 0.0 111.102 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -138.25 124.02 19.89 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.513 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 57.64 32.07 21.31 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.29 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.36 -41.38 2.59 Favored Glycine 0 C--N 1.337 0.607 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.816 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -68.87 152.25 45.54 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 120.778 0.323 . . . . 0.0 111.332 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.15 151.43 35.67 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.186 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.3 mtt85 -128.5 127.51 42.56 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.736 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.511 ' O ' HD13 ' A' ' 17' ' ' ILE . 2.8 mt -98.18 117.02 42.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.747 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.511 HD13 ' O ' ' A' ' 16' ' ' ILE . 25.5 mm -131.2 133.42 62.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-O 120.826 0.346 . . . . 0.0 111.068 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -107.41 136.88 46.47 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.047 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.437 ' CZ ' ' HA ' ' A' ' 28' ' ' VAL . 8.5 m-85 -121.24 126.93 50.81 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.5 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -82.33 150.13 27.37 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.98 179.356 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.8 mtt-85 -87.63 143.11 33.35 Favored Pre-proline 0 N--CA 1.463 0.192 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.87 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -78.92 166.54 79.06 Favored 'Cis proline' 0 C--N 1.352 0.753 0 C-N-CA 123.661 -1.391 . . . . 0.0 112.766 0.13 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.5 p -146.85 139.49 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.099 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -114.65 159.79 20.07 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.681 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.475 ' CD1' HD13 ' A' ' 59' ' ' LEU . 37.6 t80 -55.53 -40.62 72.06 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.666 -0.243 . . . . 0.0 110.958 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.12 -43.43 91.94 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.009 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -63.02 -44.64 95.37 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.987 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.609 ' O ' HG23 ' A' ' 32' ' ' VAL . 41.1 t -68.0 -47.7 77.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.907 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -64.01 -44.91 91.16 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.172 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -56.4 -43.45 79.33 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.421 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.798 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.5 OUTLIER -69.35 -49.33 56.62 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.096 179.878 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.619 HG21 ' CZ ' ' A' ' 8' ' ' PHE . 47.6 t -63.13 -44.84 99.64 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.511 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 90.4 m -58.42 -39.37 79.58 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.982 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 28.5 m -72.27 -40.8 67.37 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 121.186 -0.206 . . . . 0.0 111.303 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.798 HG23 ' O ' ' A' ' 31' ' ' LYS . 58.9 t -56.83 -51.85 62.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 120.558 0.218 . . . . 0.0 111.553 -179.396 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.666 ' CE2' HD21 ' A' ' 79' ' ' LEU . 81.6 m-85 -90.37 -27.4 19.38 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.115 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.736 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 102.44 -160.12 17.5 Favored Glycine 0 C--N 1.336 0.536 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.577 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -144.88 158.46 52.71 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 120.446 0.165 . . . . 0.0 110.868 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -87.5 131.77 12.07 Favored 'Cis proline' 0 C--N 1.346 0.427 0 C-N-CA 123.649 -1.396 . . . . 0.0 113.055 0.312 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.736 HD12 ' O ' ' A' ' 37' ' ' GLY . 17.9 mt -136.71 147.71 46.92 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.089 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -114.55 130.17 56.73 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.991 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.438 HD21 HG11 ' A' ' 32' ' ' VAL . 3.5 mt -87.8 110.07 20.21 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.873 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -115.41 119.46 36.32 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.495 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.796 ' HB3' HD21 ' A' ' 53' ' ' LEU . 12.7 t80 -98.59 130.44 45.13 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.867 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -101.95 131.02 48.59 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.642 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -77.99 -40.12 40.17 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.786 0.327 . . . . 0.0 110.797 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -174.48 -54.51 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.202 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.8 -41.08 3.85 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.353 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -100.36 165.94 11.21 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.995 0.426 . . . . 0.0 111.388 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.5 m -121.29 122.25 39.49 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.763 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.15 131.78 65.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.184 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.11 135.07 34.55 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.709 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.796 HD21 ' HB3' ' A' ' 44' ' ' TYR . 0.5 OUTLIER -98.42 86.64 3.66 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.456 179.85 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -99.55 24.57 8.04 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.672 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -166.08 160.05 16.01 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.588 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.8 -40.82 89.64 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.73 0.3 . . . . 0.0 110.394 179.428 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -61.94 -46.25 90.11 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.984 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -60.67 -44.33 96.6 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.882 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.475 HD13 ' CD1' ' A' ' 25' ' ' TYR . 4.7 tp -63.01 -42.96 99.97 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.111 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -69.45 -34.84 74.99 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.277 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.0 ttpt -62.39 -37.01 84.09 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.863 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.77 -37.86 89.05 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.991 179.31 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 33.2 mm -63.75 -43.92 98.14 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.19 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -53.9 -36.48 62.76 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.053 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.8 mt -66.63 -40.11 85.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.819 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 26.2 tp -62.39 -40.06 95.26 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.118 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.19 -34.36 68.43 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.3 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.0 -34.51 76.64 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.898 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.4 t -81.61 97.93 8.1 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.048 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.3 p -63.69 -33.76 76.36 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.404 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.8 p -71.16 -49.31 45.25 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.246 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.9 ttm -67.89 147.21 52.81 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.075 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.28 -48.34 0.59 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.31 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.41 171.11 15.57 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.706 0.289 . . . . 0.0 110.842 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.449 ' HB3' HD11 ' A' ' 77' ' ' ILE . 4.0 mm? -102.36 118.25 36.48 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.744 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -92.16 84.04 5.19 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.777 0.322 . . . . 0.0 110.93 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.449 HD11 ' HB3' ' A' ' 75' ' ' LEU . 2.9 mt -109.29 128.56 65.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.004 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.518 HD12 HD11 ' A' ' 80' ' ' LEU . 0.5 OUTLIER -113.36 123.8 50.96 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.32 -179.844 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.666 HD21 ' CE2' ' A' ' 36' ' ' PHE . 2.8 pp -112.97 131.48 55.74 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.696 179.484 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.518 HD11 HD12 ' A' ' 78' ' ' LEU . 1.7 mp -121.09 151.22 40.1 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.241 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' SER . . . . . 0.473 ' HA ' HD23 ' A' ' 40' ' ' LEU . 2.5 t -98.14 147.41 24.6 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.119 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.261 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.651 179.154 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.504 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 14.4 p-10 . . . . . 0 C--O 1.234 0.243 0 CA-C-O 120.99 0.424 . . . . 0.0 111.205 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 32.2 t -75.77 129.63 36.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.973 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -87.81 112.06 22.05 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.78 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.418 ' HA ' ' HB2' ' A' ' 75' ' ' LEU . 19.8 mt -99.11 125.9 52.49 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.02 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.0 mttt -99.33 117.67 34.28 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.8 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.449 ' CD1' HD12 ' A' ' 17' ' ' ILE . 80.0 m-85 -107.37 145.72 32.52 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.036 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -125.9 126.1 43.87 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.13 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.0 t-160 -141.27 116.94 10.31 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.567 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 16.0 m120 57.21 34.92 25.52 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.236 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.94 -38.34 3.17 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.864 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -65.3 150.81 47.62 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.759 0.314 . . . . 0.0 111.291 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.58 157.14 37.88 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.357 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.2 142.28 24.92 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.056 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.3 mp -114.59 119.56 61.87 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.941 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.449 HD12 ' CD1' ' A' ' 8' ' ' PHE . 3.1 mt -127.12 130.79 71.16 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.038 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.504 ' HB1' ' HB2' ' A' ' 3' ' ' ASP . . . -94.11 143.42 26.38 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.434 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.403 ' CD2' HD12 ' A' ' 6' ' ' ILE . 44.8 m-85 -137.6 117.08 12.86 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.903 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.9 p -72.69 143.21 48.16 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.083 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.82 153.92 37.65 Favored Pre-proline 0 C--O 1.232 0.171 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.305 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -74.53 140.57 68.02 Favored 'Cis proline' 0 C--N 1.351 0.706 0 C-N-CA 123.54 -1.442 . . . . 0.0 112.528 0.03 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.9 p -127.01 143.67 39.71 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.048 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.64 142.48 27.3 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.062 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 50.3 t80 -59.58 -36.99 77.31 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.209 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.56 -45.0 89.89 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.995 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -63.05 -44.58 95.48 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.157 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.693 ' O ' HG23 ' A' ' 32' ' ' VAL . 24.9 t -67.05 -46.7 84.0 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.935 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.444 ' HG2' HD11 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -58.64 -45.2 89.81 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.169 179.916 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -56.78 -46.77 81.29 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.761 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.755 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.3 OUTLIER -67.06 -49.83 63.81 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.3 179.784 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.693 HG23 ' O ' ' A' ' 28' ' ' VAL . 47.4 t -58.48 -43.29 86.52 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.335 -179.716 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 95.4 m -62.8 -39.45 94.3 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.02 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 39.0 m -72.08 -42.86 65.68 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 121.254 -0.178 . . . . 0.0 111.425 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.755 HG23 ' O ' ' A' ' 31' ' ' LYS . 59.7 t -56.57 -51.91 59.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-O 120.54 0.21 . . . . 0.0 111.533 -179.449 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.537 ' CE2' HD21 ' A' ' 79' ' ' LEU . 76.7 m-85 -88.32 -28.21 21.18 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.303 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.66 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 101.73 -159.95 18.17 Favored Glycine 0 C--N 1.334 0.442 0 C-N-CA 121.0 -0.619 . . . . 0.0 112.347 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.76 156.15 55.98 Favored Pre-proline 0 N--CA 1.464 0.244 0 CA-C-O 120.437 0.16 . . . . 0.0 110.787 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -88.07 131.35 10.97 Favored 'Cis proline' 0 C--N 1.35 0.639 0 C-N-CA 123.559 -1.434 . . . . 0.0 112.939 0.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.66 HD12 ' O ' ' A' ' 37' ' ' GLY . 6.4 mt -138.34 130.55 28.7 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.138 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -101.64 135.2 43.56 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.019 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.444 HD11 ' HG2' ' A' ' 29' ' ' GLU . 9.3 mt -91.27 104.16 16.74 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.781 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -106.48 129.71 54.4 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.27 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -106.1 119.32 38.91 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.582 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.414 ' O ' ' HD2' ' A' ' 76' ' ' ARG . 5.3 mtt -131.76 140.01 49.11 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.933 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 -99.35 -45.98 5.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.775 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -172.95 -64.11 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.486 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -108.82 -30.83 7.95 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.464 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.3 mt -93.73 132.58 37.95 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.716 0.293 . . . . 0.0 111.227 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 94.8 p -112.1 122.58 48.15 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.798 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.0 mp -127.5 132.72 69.01 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.032 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.526 HD23 ' N ' ' A' ' 53' ' ' LEU . 1.9 tt -102.96 131.17 50.11 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.515 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.526 ' N ' HD23 ' A' ' 52' ' ' LEU . 12.1 mt -74.52 84.75 2.03 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.085 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.2 tptt -77.86 -37.61 47.89 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.977 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -145.23 -179.24 6.51 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.139 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -57.47 -35.09 69.71 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.842 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.24 -46.18 79.69 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.963 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -60.45 -41.61 94.44 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.711 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.7 tp -63.42 -43.45 97.45 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.125 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.46 -41.11 98.52 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.254 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.04 -35.75 81.27 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.684 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.96 -38.34 90.71 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.166 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.6 mm -63.89 -42.43 95.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.083 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -56.71 -39.46 73.91 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.035 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 47.6 mt -68.36 -40.48 82.47 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.046 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.717 HD11 ' HG ' ' A' ' 75' ' ' LEU . 92.8 mt -61.05 -46.9 88.82 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.061 179.817 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.91 -31.34 70.86 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.176 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.7 mmt180 -66.94 -28.02 67.94 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.257 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.8 t -59.75 148.49 34.08 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.872 0.367 . . . . 0.0 111.502 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.07 -35.52 71.93 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.234 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -158.36 93.25 1.2 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.996 0.427 . . . . 0.0 111.754 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -167.22 107.83 0.61 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.053 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -99.28 -31.89 11.47 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.341 179.719 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.87 165.03 25.7 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.744 0.307 . . . . 0.0 111.372 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.717 ' HG ' HD11 ' A' ' 66' ' ' LEU . 0.5 OUTLIER -110.27 131.66 54.86 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.281 -179.915 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.414 ' HD2' ' O ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -87.18 78.95 8.74 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.936 179.86 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.618 HD11 HD23 ' A' ' 75' ' ' LEU . 32.7 mm -104.01 113.58 41.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.607 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.55 HD21 HD21 ' A' ' 80' ' ' LEU . 6.4 tt -110.77 117.15 32.66 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.861 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.537 HD21 ' CE2' ' A' ' 36' ' ' PHE . 2.5 pp -112.33 130.61 55.9 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.874 0.368 . . . . 0.0 110.967 179.567 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.55 HD21 HD21 ' A' ' 78' ' ' LEU . 0.4 OUTLIER -121.64 156.94 31.93 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.204 -179.747 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 6.1 t -83.01 147.65 28.04 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.779 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 33.2 tp60 . . . . . 0 CA--C 1.532 0.286 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.915 179.738 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 . . . . . 0 N--CA 1.465 0.314 0 CA-C-O 120.981 0.419 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 25.4 t -86.18 145.04 8.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.424 -179.614 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -93.49 106.41 18.38 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.017 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.2 mt -104.69 125.96 59.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.071 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -103.93 129.47 51.48 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.596 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -111.83 131.55 55.27 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.859 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.445 ' HG3' ' HG3' ' A' ' 14' ' ' ARG . 24.7 tt0 -119.39 130.01 55.09 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.819 0.342 . . . . 0.0 111.116 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.7 t-160 -141.07 121.0 13.59 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.694 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 61.07 26.2 16.16 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.604 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.36 -46.96 1.14 Allowed Glycine 0 C--N 1.338 0.644 0 C-N-CA 120.912 -0.661 . . . . 0.0 113.415 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -66.02 139.58 58.22 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.925 0.362 . . . . 0.0 111.275 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.445 ' HG3' ' HG3' ' A' ' 9' ' ' GLU . 2.6 mtt85 -108.91 155.25 21.05 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.419 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.1 149.22 50.0 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.926 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.45 ' O ' HD13 ' A' ' 17' ' ' ILE . 34.3 mt -115.32 117.68 56.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.078 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.45 HD13 ' O ' ' A' ' 16' ' ' ILE . 21.2 mm -131.57 136.49 57.17 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.257 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.53 141.32 28.74 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.992 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -128.91 117.1 20.43 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.937 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 37.8 t -86.29 140.84 29.71 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.89 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -84.79 157.53 60.46 Favored Pre-proline 0 CA--C 1.531 0.25 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.025 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.75 157.48 99.52 Favored 'Cis proline' 0 C--N 1.35 0.628 0 C-N-CA 123.486 -1.464 . . . . 0.0 112.77 0.063 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.7 p -139.25 139.25 39.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.196 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.577 ' O ' HG23 ' A' ' 28' ' ' VAL . 9.3 mptt -119.47 154.61 33.5 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.719 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.45 ' CD1' HD11 ' A' ' 59' ' ' LEU . 23.1 t80 -54.35 -45.13 72.65 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.85 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.43 -41.94 99.09 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.16 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -62.58 -44.24 96.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.987 -179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.654 ' O ' HG23 ' A' ' 32' ' ' VAL . 20.4 t -67.7 -43.25 86.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.793 179.615 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.81 -45.37 86.2 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.442 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.74 -42.75 99.38 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.315 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.789 ' O ' HG23 ' A' ' 35' ' ' VAL . 7.8 tmtt? -69.92 -49.72 49.24 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.267 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.654 HG23 ' O ' ' A' ' 28' ' ' VAL . 47.6 t -61.55 -40.91 88.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 CA-C-N 116.663 -0.244 . . . . 0.0 111.476 -179.611 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.726 HG23 ' HG3' ' A' ' 38' ' ' GLN . 22.3 m -58.62 -41.26 85.49 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.088 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 34.8 m -72.56 -37.39 68.24 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 111.524 0.194 . . . . 0.0 111.524 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.789 HG23 ' O ' ' A' ' 31' ' ' LYS . 47.1 t -61.23 -52.7 58.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 N-CA-C 111.876 0.325 . . . . 0.0 111.876 -179.425 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -98.16 -15.85 19.75 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -178.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.401 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 95.14 -156.9 21.88 Favored Glycine 0 C--N 1.334 0.457 0 C-N-CA 120.598 -0.81 . . . . 0.0 112.349 -179.28 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.726 ' HG3' HG23 ' A' ' 33' ' ' THR . 0.9 OUTLIER -144.74 158.48 53.14 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.456 0.169 . . . . 0.0 111.056 179.915 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -89.61 132.48 9.74 Favored 'Cis proline' 0 C--N 1.349 0.595 0 C-N-CA 123.771 -1.345 . . . . 0.0 112.889 0.138 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.401 HD12 ' O ' ' A' ' 37' ' ' GLY . 29.2 mt -138.53 135.45 35.08 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.012 179.787 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -114.73 139.52 49.62 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.049 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.594 ' HB3' HD12 ' A' ' 53' ' ' LEU . 5.7 mt -80.81 108.89 14.86 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.945 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.8 m80 -114.0 120.42 40.58 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.116 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.592 ' CD2' HD21 ' A' ' 53' ' ' LEU . 0.5 OUTLIER -88.88 129.53 35.58 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.854 179.721 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 17.6 mtp -125.8 117.8 24.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.53 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 20.0 m-20 -79.18 -54.25 6.17 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.794 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -172.9 -61.34 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.353 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -107.46 -24.76 11.7 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.434 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.576 HD22 HD11 ' A' ' 51' ' ' ILE . 0.3 OUTLIER -110.59 149.84 29.82 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.865 0.364 . . . . 0.0 111.389 -179.681 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.53 122.36 45.46 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.001 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.576 HD11 HD22 ' A' ' 49' ' ' LEU . 28.7 mm -114.37 131.36 66.62 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.785 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.61 HD23 ' N ' ' A' ' 53' ' ' LEU . 4.7 tt -94.78 130.52 41.29 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.783 0.325 . . . . 0.0 111.024 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.61 ' N ' HD23 ' A' ' 52' ' ' LEU . 0.7 OUTLIER -81.79 95.32 7.25 Favored 'General case' 0 CA--C 1.527 0.086 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.379 179.37 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -84.71 -36.03 22.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.122 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.1 m-20 -144.67 -179.73 6.76 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.936 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.577 ' HA ' HD12 ' A' ' 59' ' ' LEU . 13.3 tp60 -58.41 -33.41 69.63 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.8 179.459 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -53.16 -41.65 65.38 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.201 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -64.53 -40.96 96.57 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.769 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.577 HD12 ' HA ' ' A' ' 56' ' ' GLN . 11.0 mt -65.52 -42.0 92.53 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.008 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.414 ' HA ' HD12 ' A' ' 63' ' ' ILE . 4.5 m-20 -60.93 -39.81 90.83 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.91 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -68.24 -39.48 82.27 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.642 178.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.442 ' HB1' ' CZ ' ' A' ' 44' ' ' TYR . . . -65.65 -43.67 88.68 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.558 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.414 HD12 ' HA ' ' A' ' 60' ' ' ASP . 8.2 mt -62.81 -40.97 90.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 116.701 -0.227 . . . . 0.0 110.771 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -52.86 -34.97 56.8 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.24 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 30.6 mm -66.65 -45.37 88.54 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.07 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.0 mt -66.77 -45.14 79.46 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.988 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.12 -40.16 94.96 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.004 179.744 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -63.21 -35.23 79.63 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.129 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.8 t -70.48 122.14 19.1 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.899 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.74 -36.01 75.73 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.222 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 32.3 p -70.64 -81.06 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.907 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.3 tmm? 64.04 160.01 0.1 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.064 0.459 . . . . 0.0 111.696 179.508 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.34 -59.72 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.367 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 m -155.52 174.77 14.79 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.574 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.4 mp -91.95 131.66 37.1 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.413 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -95.7 74.78 3.18 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.136 0.493 . . . . 0.0 111.199 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.46 HG12 ' CE2' ' A' ' 44' ' ' TYR . 25.6 mt -103.92 129.22 56.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.819 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.9 tt -113.38 118.25 34.03 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.103 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.3 pp -104.19 131.55 51.37 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.706 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.4 pp -118.8 159.72 23.21 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.067 0.46 . . . . 0.0 111.334 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -90.72 147.6 23.15 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.77 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 . . . . . 0 N--CA 1.465 0.313 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 179.867 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.233 0 CA-C-O 120.91 0.386 . . . . 0.0 110.302 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.616 HG23 ' HG3' ' A' ' 21' ' ' ARG . 36.2 t -79.86 125.14 38.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.868 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.3 mtm105 -94.36 106.34 18.32 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.699 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.7 mp -101.92 134.43 42.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.997 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.8 mttm -100.34 118.09 35.89 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.714 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.492 ' CD1' HD12 ' A' ' 17' ' ' ILE . 93.2 m-85 -107.39 131.88 53.78 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.146 -179.762 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -126.58 131.94 51.41 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.212 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 9.0 t-160 -139.49 121.08 15.2 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.529 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.0 m-20 57.25 31.64 20.41 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.221 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.11 -30.22 7.87 Favored Glycine 0 CA--C 1.524 0.609 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.937 -179.545 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -65.61 140.57 58.53 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.761 0.315 . . . . 0.0 111.187 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -103.69 154.97 18.95 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.32 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.2 tpp180 -151.76 144.23 24.15 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.069 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.3 mt -113.66 127.64 70.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.001 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.492 HD12 ' CD1' ' A' ' 8' ' ' PHE . 20.1 mt -138.39 125.61 27.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-O 120.784 0.326 . . . . 0.0 111.29 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -112.49 131.07 55.77 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.042 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -128.07 126.8 41.93 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.75 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.3 t -68.3 128.11 35.38 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.946 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.616 ' HG3' HG23 ' A' ' 4' ' ' VAL . 8.6 mtm180 -71.35 150.83 94.21 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.062 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -74.62 125.76 11.62 Favored 'Cis proline' 0 C--N 1.35 0.645 0 C-N-CA 123.517 -1.451 . . . . 0.0 112.308 0.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.5 p -73.58 131.91 34.19 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.04 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.504 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -96.98 127.14 42.66 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.154 -179.762 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.484 ' OH ' HD22 ' A' ' 42' ' ' LEU . 71.3 t80 -53.95 -43.72 70.1 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.076 179.565 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.406 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 1.4 mm-40 -60.97 -38.85 87.38 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.087 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -69.17 -44.27 72.58 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.124 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 24' ' ' LYS . 22.0 t -63.76 -47.24 91.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.019 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.406 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 11.5 pt-20 -63.91 -36.75 84.96 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.186 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -56.68 -45.22 81.87 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.583 0.23 . . . . 0.0 111.061 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.574 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.3 OUTLIER -68.89 -48.84 62.36 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.325 179.819 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 50.0 t -62.63 -40.58 88.92 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.538 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.73 HG23 ' HB3' ' A' ' 38' ' ' GLN . 79.9 m -61.01 -47.26 87.27 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.896 -0.138 . . . . 0.0 111.269 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.0 m -72.88 -44.52 61.21 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 31' ' ' LYS . 70.1 t -67.1 -44.8 87.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.235 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.575 ' HB2' HD11 ' A' ' 40' ' ' LEU . 15.9 m-85 -100.28 7.06 44.65 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.09 172.7 23.59 Favored Glycine 0 C--N 1.339 0.704 0 C-N-CA 120.503 -0.856 . . . . 0.0 112.88 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.73 ' HB3' HG23 ' A' ' 33' ' ' THR . 6.8 pt20 -135.04 154.65 79.23 Favored Pre-proline 0 C--O 1.234 0.242 0 O-C-N 122.853 -0.204 . . . . 0.0 110.98 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.43 ' HG2' ' HB3' ' A' ' 82' ' ' GLN . 95.7 Cg_endo -88.02 153.61 38.33 Favored 'Cis proline' 0 C--N 1.35 0.609 0 C-N-CA 123.567 -1.43 . . . . 0.0 113.338 0.544 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.575 HD11 ' HB2' ' A' ' 36' ' ' PHE . 15.7 mt -124.6 160.4 28.51 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.08 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -111.46 126.3 54.8 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.661 179.36 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.484 HD22 ' OH ' ' A' ' 25' ' ' TYR . 5.2 mp -90.23 96.24 10.57 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.818 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -115.22 122.98 47.66 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.284 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.537 ' HB2' HD21 ' A' ' 53' ' ' LEU . 11.7 t80 -105.79 129.4 53.99 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.691 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -131.27 120.73 23.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.731 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -85.02 -68.42 0.73 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.851 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -149.08 -74.61 0.17 Allowed 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.393 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -110.1 4.66 21.4 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.433 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.465 HD12 HD11 ' A' ' 51' ' ' ILE . 0.6 OUTLIER -130.12 140.03 50.84 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.792 0.329 . . . . 0.0 111.277 -179.917 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -115.23 128.3 56.06 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.712 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.465 HD11 HD12 ' A' ' 49' ' ' LEU . 18.8 mt -128.39 134.26 65.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.958 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 39.8 mt -93.85 132.81 37.9 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.941 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.537 HD21 ' HB2' ' A' ' 44' ' ' TYR . 0.8 OUTLIER -122.95 88.04 2.86 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.011 0.434 . . . . 0.0 111.26 179.719 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.92 -32.51 14.54 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.969 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -100.87 166.64 10.74 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.982 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -31.98 73.44 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.027 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -56.82 -50.11 73.35 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.063 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -63.09 -45.02 94.1 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.822 0.344 . . . . 0.0 110.802 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.3 tp -58.59 -45.88 88.16 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.022 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.63 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.4 OUTLIER -63.79 -42.18 97.79 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.012 179.892 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.8 tmtt? -62.34 -38.63 90.21 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.729 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.74 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -62.42 -39.88 94.75 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.54 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.63 HD12 ' HA ' ' A' ' 60' ' ' ASP . 12.7 mt -63.57 -43.73 98.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-O 120.606 0.241 . . . . 0.0 110.881 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -56.17 -39.5 72.43 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.11 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.74 HD12 ' HA ' ' A' ' 62' ' ' ALA . 12.4 mt -64.03 -45.03 97.83 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.907 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.638 HD13 HD12 ' A' ' 75' ' ' LEU . 5.5 tt -61.85 -47.35 85.45 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.673 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -58.6 -40.31 82.89 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.076 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -33.14 74.02 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.384 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 33.6 t -83.2 119.97 25.22 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.754 0.311 . . . . 0.0 111.208 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.4 p -68.0 -35.37 78.21 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.921 179.286 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.99 -37.08 67.13 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.402 -179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.45 ' SD ' HD12 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -80.89 109.0 15.03 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.711 0.291 . . . . 0.0 111.132 -179.844 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.77 -31.99 7.24 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.784 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.2 m -122.15 154.35 37.54 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.656 0.265 . . . . 0.0 110.948 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.638 HD12 HD13 ' A' ' 66' ' ' LEU . 1.1 mp -92.74 117.35 29.91 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.174 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.74 86.1 3.99 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.384 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.9 mt -102.26 131.79 49.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.681 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 41.8 tp -102.12 117.25 34.38 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.755 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.7 pp -104.87 126.95 52.48 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.865 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.8 mp -119.2 122.74 42.67 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.849 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' SER . . . . . 0.526 ' HA ' HD23 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -74.75 142.84 44.3 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.153 -179.89 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLN . . . . . 0.43 ' HB3' ' HG2' ' A' ' 39' ' ' PRO . 0.3 OUTLIER . . . . . 0 N--CA 1.464 0.26 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.904 179.584 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 p30 . . . . . 0 N--CA 1.464 0.271 0 CA-C-O 120.875 0.369 . . . . 0.0 111.403 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.445 HG12 HD21 ' A' ' 75' ' ' LEU . 17.6 t -150.09 128.26 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.993 179.652 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -97.09 116.27 29.0 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.637 0.256 . . . . 0.0 110.963 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.735 HG12 HD11 ' A' ' 75' ' ' LEU . 21.7 mt -107.52 118.16 54.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.183 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.492 ' CD ' ' HB3' ' A' ' 74' ' ' SER . 0.0 OUTLIER -95.03 109.59 21.61 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.71 179.786 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -104.28 142.25 34.86 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.154 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -134.47 124.24 25.28 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.886 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -142.28 121.21 12.8 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.699 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 62.1 t30 57.16 34.0 24.18 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.88 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 91.02 -32.23 5.25 Favored Glycine 0 C--N 1.337 0.622 0 C-N-CA 121.047 -0.596 . . . . 0.0 113.075 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.35 136.86 55.47 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.836 0.35 . . . . 0.0 111.247 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -114.19 142.6 46.04 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.946 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.8 mtm-85 -134.11 140.49 46.63 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.172 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.461 HD12 ' HE2' ' A' ' 7' ' ' LYS . 25.9 mm -114.1 117.44 55.52 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.003 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.1 mt -125.78 137.89 56.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.215 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -110.54 133.94 52.84 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.172 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -125.4 122.83 37.86 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.196 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.88 158.49 19.31 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.042 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.05 154.95 40.58 Favored Pre-proline 0 CA--C 1.531 0.245 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.955 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -76.7 126.6 13.55 Favored 'Cis proline' 0 C--N 1.351 0.71 0 C-N-CA 123.396 -1.502 . . . . 0.0 112.737 -0.057 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.5 p -90.07 146.82 5.72 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.335 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.652 ' O ' HG23 ' A' ' 28' ' ' VAL . 4.5 mtpt -120.82 143.66 48.75 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.098 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 24.3 t80 -54.79 -52.97 60.98 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.077 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.445 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 0.3 OUTLIER -61.1 -34.82 75.55 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.163 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.33 -43.54 77.29 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.139 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.668 ' O ' HG23 ' A' ' 32' ' ' VAL . 43.5 t -63.18 -47.63 91.44 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.126 0 CA-C-N 116.693 -0.231 . . . . 0.0 111.146 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.445 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 9.3 pt-20 -64.49 -37.9 89.13 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.276 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -49.03 76.55 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.722 -0.217 . . . . 0.0 110.892 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.66 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.1 OUTLIER -67.74 -48.96 64.98 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.278 179.861 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.668 HG23 ' O ' ' A' ' 28' ' ' VAL . 43.0 t -59.17 -41.44 83.73 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 116.678 -0.237 . . . . 0.0 111.358 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 99.4 m -65.01 -41.45 95.32 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.908 -0.133 . . . . 0.0 111.042 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.9 m -72.76 -43.71 62.53 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 121.108 -0.237 . . . . 0.0 111.617 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' ' 31' ' ' LYS . 48.5 t -66.47 -49.67 73.41 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 N-CA-C 111.574 0.213 . . . . 0.0 111.574 -179.411 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -88.71 -10.72 47.41 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -179.08 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.5 ' O ' HD13 ' A' ' 40' ' ' LEU . . . 91.21 -176.89 40.8 Favored Glycine 0 C--N 1.338 0.65 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.575 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.416 ' HA ' HD12 ' A' ' 40' ' ' LEU . 1.0 OUTLIER -145.19 156.31 54.35 Favored Pre-proline 0 N--CA 1.465 0.285 0 CA-C-O 120.528 0.204 . . . . 0.0 110.83 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.527 ' C ' HD12 ' A' ' 40' ' ' LEU . 92.0 Cg_endo -93.25 128.22 5.12 Favored 'Cis proline' 0 C--N 1.351 0.699 0 C-N-CA 123.918 -1.284 . . . . 0.0 112.933 0.099 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.801 HD23 HD13 ' A' ' 79' ' ' LEU . 6.3 mp -134.57 139.98 45.78 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.992 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.66 139.47 38.2 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.137 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.576 HD21 HG11 ' A' ' 32' ' ' VAL . 0.8 OUTLIER -91.06 106.47 18.54 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.213 -179.8 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -101.65 118.98 38.05 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.251 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.418 ' OH ' ' HB1' ' A' ' 62' ' ' ALA . 2.2 t80 -88.95 118.5 28.72 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.822 179.652 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.684 ' HB2' HD21 ' A' ' 78' ' ' LEU . 0.9 OUTLIER -130.63 116.16 17.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.764 179.891 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -80.85 -50.35 9.9 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.791 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.45 -63.7 0.02 OUTLIER 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.61 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.6 mp0 -109.54 -24.12 11.15 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.726 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.7 mp -103.4 138.83 39.6 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.79 0.328 . . . . 0.0 111.317 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 87.2 p -114.32 121.62 44.19 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.87 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.5 mp -124.44 134.28 67.12 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.712 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 14.6 tp -98.96 124.91 44.23 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.771 -0.195 . . . . 0.0 110.705 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.486 HD22 HD23 ' A' ' 59' ' ' LEU . 1.5 mt -65.0 103.42 0.73 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.912 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.1 mtmm -103.1 -31.78 9.99 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.703 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -148.08 173.85 12.52 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.779 0.323 . . . . 0.0 111.465 -179.414 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.468 ' HA ' HD12 ' A' ' 59' ' ' LEU . 1.3 mt-30 -56.94 -29.72 63.4 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.138 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -53.08 -41.74 65.19 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.036 179.747 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -68.39 -40.67 81.28 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.761 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.486 HD23 HD22 ' A' ' 53' ' ' LEU . 36.5 mt -63.52 -40.28 96.62 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.526 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.87 ' HA ' HD12 ' A' ' 63' ' ' ILE . 1.2 t0 -67.22 -37.62 83.9 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.163 179.627 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.47 -36.69 83.28 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.769 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.418 ' HB1' ' OH ' ' A' ' 44' ' ' TYR . . . -62.84 -37.71 87.86 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.185 179.344 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.87 HD12 ' HA ' ' A' ' 60' ' ' ASP . 11.1 mt -63.84 -44.29 98.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.951 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.03 -39.34 69.02 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.063 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 29.5 mt -66.79 -42.97 90.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.015 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 40.4 mt -67.45 -46.41 73.15 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.139 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -60.98 -38.94 87.76 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.369 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -65.69 -32.68 74.37 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.427 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 33.8 t -109.26 93.59 4.59 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.959 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.8 m -59.48 -27.28 65.98 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.765 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.0 t -57.67 -35.39 70.5 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.542 0.21 . . . . 0.0 111.282 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -117.21 163.17 16.7 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.762 0.315 . . . . 0.0 111.251 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -162.24 36.56 0.12 Allowed 'General case' 0 C--O 1.235 0.342 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.265 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.492 ' HB3' ' CD ' ' A' ' 7' ' ' LYS . 0.9 OUTLIER -143.18 149.11 37.57 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.708 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.735 HD11 HG12 ' A' ' 6' ' ' ILE . 0.1 OUTLIER -111.58 132.92 54.2 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.855 179.78 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.81 119.45 36.43 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.956 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.436 HD11 HD12 ' A' ' 75' ' ' LEU . 16.0 mt -128.45 118.33 47.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.873 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.684 HD21 ' HB2' ' A' ' 45' ' ' MET . 0.4 OUTLIER -106.3 122.17 45.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.955 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.801 HD13 HD23 ' A' ' 40' ' ' LEU . 3.0 pp -114.36 135.85 53.63 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.691 179.689 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.485 ' N ' HD12 ' A' ' 80' ' ' LEU . 3.0 mp -114.3 144.35 43.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.792 -179.636 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -98.84 136.55 38.7 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.008 0.433 . . . . 0.0 110.999 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.278 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.123 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 . . . . . 0 C--O 1.234 0.25 0 CA-C-O 120.889 0.376 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.2 t -131.34 129.0 62.11 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.966 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.443 ' NH1' HG22 ' A' ' 16' ' ' ILE . 5.8 mtt-85 -88.5 112.72 23.31 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.952 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.555 HD12 ' HD2' ' A' ' 19' ' ' PHE . 6.2 mt -106.33 128.65 60.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.956 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.5 mtpt -104.04 125.23 50.23 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.586 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.502 ' CE1' HD12 ' A' ' 17' ' ' ILE . 20.6 m-85 -109.21 144.54 37.18 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.213 -179.585 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -121.77 124.0 43.16 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.294 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' HIS . . . . . 0.676 ' HB2' HD11 ' A' ' 79' ' ' LEU . 12.1 t-160 -141.2 115.83 9.6 Favored 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.438 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 56.8 m-20 58.21 30.9 20.1 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 120.818 0.342 . . . . 0.0 111.137 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.9 -2.79 87.7 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 121.105 -0.569 . . . . 0.0 113.296 -179.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -85.64 143.08 28.63 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 117.216 0.508 . . . . 0.0 110.886 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.01 137.74 43.41 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.12 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -133.94 133.78 41.8 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.788 179.699 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.443 HG22 ' NH1' ' A' ' 5' ' ' ARG . 3.4 mp -114.07 117.29 55.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.073 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.502 HD12 ' CE1' ' A' ' 8' ' ' PHE . 10.9 mt -129.38 131.36 67.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.157 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -102.81 145.41 29.8 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.136 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.555 ' HD2' HD12 ' A' ' 6' ' ' ILE . 46.2 m-85 -138.84 116.9 11.71 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.031 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.4 p -78.98 135.84 37.04 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.031 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.1 mtt180 -74.87 152.81 86.87 Favored Pre-proline 0 CA--C 1.531 0.243 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.844 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -72.79 129.04 16.46 Favored 'Cis proline' 0 C--N 1.35 0.611 0 C-N-CA 123.763 -1.349 . . . . 0.0 112.426 0.198 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.431 ' O ' HG13 ' A' ' 23' ' ' VAL . 15.0 p -99.94 118.8 47.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.163 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.495 ' O ' HG23 ' A' ' 28' ' ' VAL . 11.0 mmmt -91.32 132.44 36.17 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.979 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.52 ' CD2' HD22 ' A' ' 59' ' ' LEU . 38.6 t80 -54.44 -41.64 69.64 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.704 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -59.32 -45.32 91.64 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.051 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.69 -44.63 85.59 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.121 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.677 ' O ' HG23 ' A' ' 32' ' ' VAL . 38.9 t -62.91 -47.94 90.39 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.918 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -60.78 -41.61 95.91 Favored 'General case' 0 N--CA 1.461 0.1 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.936 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -57.23 -48.43 78.85 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.119 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.692 ' O ' HG23 ' A' ' 35' ' ' VAL . 4.9 tttt -68.62 -49.5 58.71 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.257 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.677 HG23 ' O ' ' A' ' 28' ' ' VAL . 45.6 t -58.4 -44.67 89.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 CA-C-N 116.814 -0.176 . . . . 0.0 111.295 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 91.1 m -66.79 -39.38 87.76 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.192 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.4 m -72.15 -43.24 64.94 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.692 HG23 ' O ' ' A' ' 31' ' ' LYS . 60.6 t -64.92 -51.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-O 120.463 0.173 . . . . 0.0 111.246 -179.515 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -83.67 -20.37 33.67 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -179.435 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.525 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 100.08 -179.77 29.95 Favored Glycine 0 C--N 1.338 0.656 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.521 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -139.55 156.36 71.39 Favored Pre-proline 0 N--CA 1.464 0.26 0 O-C-N 122.73 -0.276 . . . . 0.0 111.175 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.41 ' HG2' ' HB2' ' A' ' 82' ' ' GLN . 95.2 Cg_endo -85.75 137.04 21.62 Favored 'Cis proline' 0 C--N 1.35 0.621 0 C-N-CA 123.438 -1.484 . . . . 0.0 112.897 0.091 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.525 HD12 ' O ' ' A' ' 37' ' ' GLY . 47.4 mt -137.9 130.07 28.96 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.515 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -103.68 138.78 39.84 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.9 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.579 HD21 HG11 ' A' ' 32' ' ' VAL . 4.2 mt -95.62 110.4 22.51 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.786 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -111.09 126.71 55.12 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.954 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.469 ' HD2' HD22 ' A' ' 53' ' ' LEU . 0.5 OUTLIER -89.14 126.33 35.42 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.722 179.736 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -131.2 118.55 20.59 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.617 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -83.61 -58.99 2.58 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.675 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -175.31 -52.29 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.544 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -109.37 -30.6 7.89 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.542 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.9 mp -112.41 154.77 25.27 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.788 0.328 . . . . 0.0 111.222 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -121.27 126.78 50.4 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.91 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 28.3 mm -113.75 134.44 56.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.859 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -96.59 126.7 41.95 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.792 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.614 HD13 HD13 ' A' ' 59' ' ' LEU . 0.5 OUTLIER -99.37 87.33 3.59 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 121.045 0.45 . . . . 0.0 110.835 179.939 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.3 mtpp -105.03 -34.2 8.06 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.138 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -103.92 163.49 12.33 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 120.78 0.324 . . . . 0.0 110.973 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.1 tm0? -63.34 -37.95 89.25 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.799 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.55 -38.54 84.82 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.206 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.62 -49.92 75.57 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.04 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.614 HD13 HD13 ' A' ' 53' ' ' LEU . 13.0 tp -63.89 -40.94 97.68 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.93 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.561 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.4 OUTLIER -67.06 -37.62 84.35 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.213 179.726 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -62.66 -39.35 93.63 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.665 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.75 -38.27 90.47 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.088 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.619 ' HA ' HD12 ' A' ' 66' ' ' LEU . 25.2 mt -65.49 -41.9 92.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.141 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.45 -39.59 67.57 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.037 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 45.1 mt -64.7 -38.37 82.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.949 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.728 HD11 ' HG ' ' A' ' 75' ' ' LEU . 15.9 mt -64.17 -45.37 88.73 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.828 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.86 -32.63 69.62 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.302 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.1 mtt-85 -66.09 -31.81 72.9 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.119 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.5 t -104.02 112.07 24.9 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.241 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.71 -33.4 71.57 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.461 179.49 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.8 p -72.79 -71.08 0.31 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.432 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.74 106.32 6.24 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 120.842 0.353 . . . . 0.0 111.384 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 25.1 pttt -114.74 -35.84 4.71 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.483 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.87 170.3 11.4 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 120.714 0.292 . . . . 0.0 111.526 -179.649 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.728 ' HG ' HD11 ' A' ' 66' ' ' LEU . 6.2 mp -114.9 133.5 55.93 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.399 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -102.6 81.45 2.03 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.517 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.5 mt -106.42 129.64 59.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.016 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.2 pp -109.03 132.65 53.91 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.023 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.676 HD11 ' HB2' ' A' ' 10' ' ' HIS . 3.1 pp -111.15 135.9 50.99 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.634 179.587 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.6 mt -112.57 146.9 37.73 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.168 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.5 t -94.57 147.89 22.81 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.811 179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLN . . . . . 0.41 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 1.7 mm-40 . . . . . 0 N--CA 1.467 0.376 0 N-CA-C 112.378 0.511 . . . . 0.0 112.378 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 . . . . . 0 N--CA 1.466 0.37 0 CA-C-O 120.676 0.274 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.657 HG21 ' NH2' ' A' ' 21' ' ' ARG . 21.3 t -134.37 146.78 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.616 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -93.67 133.08 37.4 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.981 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.483 HD12 ' CD1' ' A' ' 19' ' ' PHE . 29.7 mt -114.76 136.4 51.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.918 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.7 mttt -108.25 122.39 46.84 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.753 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -116.66 139.89 50.02 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.873 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.649 ' HB2' HD12 ' A' ' 78' ' ' LEU . 0.3 OUTLIER -119.34 131.37 55.71 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.1 -179.826 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.6 t-160 -136.01 114.7 11.96 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.658 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 57.72 35.14 25.28 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.218 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 95.23 -35.22 4.38 Favored Glycine 0 C--N 1.337 0.635 0 C-N-CA 120.915 -0.66 . . . . 0.0 113.005 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.39 150.47 48.24 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.611 0.243 . . . . 0.0 111.135 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -118.37 141.01 48.97 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.221 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 91.9 mtt-85 -129.14 147.77 51.02 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.1 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 19.2 mt -115.03 126.45 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.087 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 9.2 tp -140.22 135.31 36.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.278 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -101.85 141.19 35.08 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.14 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.483 ' CD1' HD12 ' A' ' 6' ' ' ILE . 9.5 m-85 -126.52 153.05 45.69 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.119 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 47.5 t -95.31 142.84 27.24 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.19 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.657 ' NH2' HG21 ' A' ' 4' ' ' VAL . 0.2 OUTLIER -97.12 140.85 22.31 Favored Pre-proline 0 CA--C 1.53 0.208 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.633 179.627 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.409 ' HA ' ' CG ' ' A' ' 21' ' ' ARG . 4.0 Cg_exo -74.6 143.89 79.24 Favored 'Cis proline' 0 C--N 1.351 0.695 0 C-N-CA 123.78 -1.342 . . . . 0.0 112.676 0.172 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.0 p -105.99 133.79 49.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.908 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.522 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -97.9 142.71 29.3 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.924 -179.664 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -60.34 -43.7 96.2 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.979 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -60.05 -41.88 93.29 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.951 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.95 -44.48 92.68 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.328 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.695 ' O ' HG23 ' A' ' 32' ' ' VAL . 33.4 t -67.28 -47.47 81.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.78 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -57.87 -45.78 85.82 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.161 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -56.87 -47.3 80.75 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.102 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.716 ' O ' HG23 ' A' ' 35' ' ' VAL . 25.9 tttt -67.09 -49.57 64.54 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.17 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.695 HG23 ' O ' ' A' ' 28' ' ' VAL . 47.9 t -58.26 -44.76 88.76 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.344 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 87.7 m -61.2 -40.42 93.88 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.151 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 20.5 m -72.54 -42.93 64.19 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 111.525 0.194 . . . . 0.0 111.525 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.716 HG23 ' O ' ' A' ' 31' ' ' LYS . 62.1 t -62.54 -52.23 62.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.421 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -87.09 -18.77 29.73 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -179.182 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 98.11 179.66 32.78 Favored Glycine 0 C--N 1.337 0.622 0 C-N-CA 120.65 -0.785 . . . . 0.0 112.612 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.3 pm0 -140.36 154.14 69.38 Favored Pre-proline 0 N--CA 1.465 0.315 0 O-C-N 122.863 -0.198 . . . . 0.0 110.927 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -83.3 143.87 48.6 Favored 'Cis proline' 0 C--N 1.35 0.618 0 C-N-CA 123.525 -1.448 . . . . 0.0 113.033 0.31 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.744 HD13 HD13 ' A' ' 79' ' ' LEU . 17.8 mt -138.52 138.93 38.5 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.155 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -104.83 119.44 39.01 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.987 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.84 113.63 22.14 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.943 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -114.08 119.52 37.41 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.135 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -101.85 129.76 48.15 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.694 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.66 133.33 55.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.785 179.586 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -83.32 -59.65 2.39 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.521 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -149.97 -65.11 0.21 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.408 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.481 ' O ' HD22 ' A' ' 49' ' ' LEU . 3.2 mp0 -123.21 10.74 9.35 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.54 179.621 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.481 HD22 ' O ' ' A' ' 48' ' ' GLU . 3.9 mm? -126.75 164.77 20.6 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.625 0.25 . . . . 0.0 111.114 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -121.06 118.43 29.77 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.888 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 22.3 mt -120.17 133.06 68.12 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.991 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.31 122.75 45.45 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.86 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.52 91.82 6.97 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.722 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.8 -32.17 16.2 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.397 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -116.1 162.33 17.58 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.758 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -62.31 -31.36 71.97 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.991 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -53.45 -46.0 69.72 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.771 0.319 . . . . 0.0 110.815 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.38 -37.36 87.22 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.299 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.65 HD13 ' C ' ' A' ' 59' ' ' LEU . 1.2 tm? -61.24 -47.14 87.41 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.482 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.425 ' N ' HD13 ' A' ' 59' ' ' LEU . 31.4 t70 -68.39 -32.15 72.02 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.151 179.548 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.0 tttm -62.64 -38.44 90.28 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.765 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.602 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -65.76 -36.11 82.62 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.069 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 36.4 mm -59.36 -47.78 89.38 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.836 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -55.49 -42.61 74.65 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.917 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.602 HD12 ' HA ' ' A' ' 62' ' ' ALA . 9.9 mt -67.73 -43.09 86.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.141 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.959 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 13.9 tp -58.74 -45.57 89.37 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.83 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -65.83 -32.65 74.29 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.18 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.6 mmt180 -64.69 -33.51 76.13 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.32 179.714 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 42.2 t -103.36 111.25 23.58 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.184 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 51.6 p -62.49 -39.97 95.19 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.968 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 32.8 p -61.14 -34.65 75.34 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.435 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.5 ttp -90.89 92.52 8.81 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.715 0.293 . . . . 0.0 110.99 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -97.86 -34.63 10.78 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.169 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.2 m -92.2 166.71 12.49 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.838 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.8 mt -97.53 120.72 38.42 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.964 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -89.66 84.51 6.32 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.684 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 15.2 mt -117.72 124.14 72.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.126 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.649 HD12 ' HB2' ' A' ' 9' ' ' GLU . 1.3 tp -111.38 117.37 32.91 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.813 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.744 HD13 HD13 ' A' ' 40' ' ' LEU . 3.3 pp -103.3 136.18 43.56 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.847 0.356 . . . . 0.0 111.158 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.7 mp -119.26 158.13 26.66 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.156 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' SER . . . . . 0.635 ' HA ' HD23 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -88.91 137.1 32.62 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.076 179.839 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 48.4 tp60 . . . . . 0 N--CA 1.466 0.361 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.806 179.603 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.467 0.421 0 CA-C-O 120.686 0.279 . . . . 0.0 111.407 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.7 t -140.16 127.38 23.62 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.003 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.1 120.08 28.0 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.917 0.389 . . . . 0.0 111.172 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.831 HG23 HD12 ' A' ' 77' ' ' ILE . 30.2 mm -106.27 117.7 52.52 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.055 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.0 mttt -101.87 111.56 23.86 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.541 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.467 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 1.8 p90 -117.0 142.58 46.77 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.179 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -122.39 140.07 53.12 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.444 -179.53 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.2 t-160 -140.94 113.39 8.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.439 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.2 m120 59.76 31.42 20.81 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.541 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 104.18 -43.95 1.57 Allowed Glycine 0 C--N 1.335 0.505 0 C-N-CA 120.847 -0.692 . . . . 0.0 113.223 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -70.96 135.85 48.14 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.762 0.281 . . . . 0.0 111.119 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -119.24 156.73 29.39 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.787 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.467 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 1.1 tpt180 -141.39 143.74 34.11 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.285 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.412 ' O ' HD13 ' A' ' 17' ' ' ILE . 2.4 mt -116.9 118.93 60.44 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.054 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.412 HD13 ' O ' ' A' ' 16' ' ' ILE . 27.4 mm -129.95 137.58 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-O 120.746 0.308 . . . . 0.0 111.262 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.09 145.95 24.62 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.228 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.479 ' CZ ' HG13 ' A' ' 28' ' ' VAL . 33.8 m-85 -133.37 117.88 17.79 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.166 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 65.7 m -72.95 136.13 45.13 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.243 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 44.1 mtm180 -100.45 156.83 34.77 Favored Pre-proline 0 CA--C 1.53 0.182 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.006 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.18 122.28 8.11 Favored 'Cis proline' 0 C--N 1.35 0.654 0 C-N-CA 123.258 -1.559 . . . . 0.0 112.657 0.059 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.7 p -104.36 153.23 6.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.168 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -104.81 137.02 43.23 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.685 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -54.88 -37.06 65.81 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.67 179.502 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -58.52 -45.1 89.52 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.002 179.79 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -67.33 -44.66 78.55 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.161 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.479 HG13 ' CZ ' ' A' ' 19' ' ' PHE . 30.0 t -62.34 -47.32 93.59 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.127 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.85 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.27 -44.25 95.48 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.906 179.583 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -56.8 -40.92 76.83 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.098 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.791 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.3 OUTLIER -67.64 -49.47 62.77 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.167 179.772 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 28' ' ' VAL . 25.5 t -64.79 -41.29 91.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.373 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 96.5 m -60.17 -39.52 86.71 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.158 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 16.5 m -71.89 -29.09 63.97 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 121.238 -0.185 . . . . 0.0 111.344 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 31' ' ' LYS . 44.8 t -69.37 -53.67 23.87 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-O 120.583 0.23 . . . . 0.0 111.449 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -94.18 -11.22 30.83 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -178.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.602 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 101.92 177.39 28.04 Favored Glycine 0 C--N 1.335 0.504 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.646 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -129.46 153.89 80.68 Favored Pre-proline 0 C--O 1.233 0.227 0 CA-C-O 120.623 0.249 . . . . 0.0 111.18 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -89.12 136.1 12.6 Favored 'Cis proline' 0 C--N 1.349 0.582 0 C-N-CA 123.494 -1.461 . . . . 0.0 112.919 0.203 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.712 HD23 ' HA ' ' A' ' 81' ' ' SER . 55.3 mt -138.03 136.14 36.58 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.722 179.601 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -115.19 140.55 48.99 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.051 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 mp -81.74 112.31 18.79 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.508 179.676 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -101.36 129.86 47.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 -179.644 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.855 ' HB2' HD21 ' A' ' 53' ' ' LEU . 0.9 OUTLIER -88.88 124.42 34.19 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-O 120.742 0.306 . . . . 0.0 111.32 -179.878 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 4.6 tpp -126.23 107.74 10.64 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.771 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.2 m-20 -78.91 -60.81 2.23 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.863 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -154.92 -59.07 0.11 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.573 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.43 11.78 6.38 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.553 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -131.59 152.49 50.75 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.648 0.261 . . . . 0.0 111.428 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 t -120.18 126.64 51.16 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.924 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.424 ' HB ' ' HB3' ' A' ' 44' ' ' TYR . 3.4 mt -114.1 134.33 57.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.855 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -93.84 126.78 39.23 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.85 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.855 HD21 ' HB2' ' A' ' 44' ' ' TYR . 1.3 mm? -100.54 96.77 7.6 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.033 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.4 tttm -93.98 -32.92 13.64 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.277 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.0 m-20 -136.99 173.2 11.95 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.754 0.311 . . . . 0.0 111.14 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -60.25 -29.81 69.02 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.958 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -53.65 -43.94 69.18 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.093 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -66.88 -38.37 86.17 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.645 179.49 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.44 -45.32 91.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.162 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.72 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.5 OUTLIER -62.14 -41.32 98.16 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.194 -179.837 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -62.32 -38.82 90.89 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.65 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.406 ' HB1' ' CZ ' ' A' ' 44' ' ' TYR . . . -63.6 -41.32 98.34 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.584 179.697 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.72 HD12 ' HA ' ' A' ' 60' ' ' ASP . 8.2 mt -63.55 -44.63 98.73 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-O 120.66 0.267 . . . . 0.0 110.762 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.39 -42.3 77.7 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.174 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.1 mt -68.02 -42.41 85.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.087 179.697 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 10.0 tp -59.62 -46.21 89.67 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.976 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.37 -35.62 70.21 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.24 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.62 -31.74 63.7 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.098 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.7 t -64.76 141.42 58.78 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.439 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.5 t -70.3 -30.73 67.8 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.772 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 47.7 p -92.7 37.11 1.01 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.881 0.372 . . . . 0.0 111.484 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -72.0 140.76 49.24 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.977 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -179.04 -43.3 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.073 179.677 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 64.1 m -147.14 178.06 8.68 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.798 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.451 HD13 HD13 ' A' ' 6' ' ' ILE . 6.7 mp -106.72 119.36 39.12 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.89 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.0 ttp180 -82.56 77.94 9.26 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.995 0.426 . . . . 0.0 110.608 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.831 HD12 HG23 ' A' ' 6' ' ' ILE . 22.1 mt -104.4 118.58 51.89 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.883 -179.82 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.648 HD23 HD11 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -102.2 127.42 49.14 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.048 -179.879 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.559 HD12 ' O ' ' A' ' 79' ' ' LEU . 3.3 pp -111.15 131.13 55.35 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.046 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.648 HD11 HD23 ' A' ' 78' ' ' LEU . 1.7 mp -140.87 151.15 44.08 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.873 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' SER . . . . . 0.712 ' HA ' HD23 ' A' ' 40' ' ' LEU . 0.4 OUTLIER -67.79 132.7 47.9 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.993 179.92 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.284 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.288 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.6 t70 . . . . . 0 N--CA 1.464 0.244 0 CA-C-O 120.98 0.419 . . . . 0.0 111.053 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.4 t -81.0 125.02 39.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.016 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.11 115.47 29.09 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.604 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.468 ' N ' HD12 ' A' ' 6' ' ' ILE . 3.8 mp -110.1 134.05 53.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.059 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.64 114.95 29.08 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.679 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.604 ' HB3' HD21 ' A' ' 79' ' ' LEU . 61.2 m-85 -103.2 127.03 50.64 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.775 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -120.33 124.05 44.61 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.916 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.8 t-160 -139.27 116.23 10.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.547 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.27 31.7 21.38 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.174 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.66 -28.79 9.42 Favored Glycine 0 C--N 1.339 0.695 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.867 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -65.03 137.4 57.68 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.796 0.331 . . . . 0.0 111.098 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -110.23 136.05 50.04 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.014 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.1 mtp180 -130.03 136.49 49.45 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.96 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.5 mp -114.38 117.4 55.46 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.873 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.407 HD12 ' CD2' ' A' ' 8' ' ' PHE . 19.9 mt -131.87 137.06 55.78 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 CA-C-O 120.828 0.347 . . . . 0.0 111.27 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -101.67 132.54 47.31 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.079 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.456 ' HD2' HD13 ' A' ' 6' ' ' ILE . 24.3 m-85 -124.96 126.48 45.54 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.977 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.1 m -72.78 153.89 40.9 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.375 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.5 mtt180 -95.48 146.98 32.27 Favored Pre-proline 0 CA--C 1.53 0.208 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.166 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -78.24 124.08 10.25 Favored 'Cis proline' 0 C--N 1.349 0.569 0 C-N-CA 123.313 -1.536 . . . . 0.0 112.49 -0.052 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.0 p -69.34 126.88 30.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.99 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.567 ' O ' HG23 ' A' ' 28' ' ' VAL . 23.1 mmmt -102.18 147.69 26.33 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.029 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.527 ' CZ ' HD12 ' A' ' 42' ' ' LEU . 33.4 t80 -60.42 -40.18 90.09 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.65 179.446 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -62.23 -44.71 95.94 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.246 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.85 -44.35 96.37 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.189 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.568 ' O ' HG23 ' A' ' 32' ' ' VAL . 35.9 t -65.86 -46.92 87.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.479 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -63.11 -42.15 99.5 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.266 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -56.2 -43.07 78.15 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.56 0.219 . . . . 0.0 111.471 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.687 ' O ' HG23 ' A' ' 35' ' ' VAL . 4.1 mttp -70.38 -49.7 46.36 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.183 179.794 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 28' ' ' VAL . 38.6 t -62.4 -40.98 90.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.463 -179.809 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.791 HG23 ' HB3' ' A' ' 38' ' ' GLN . 52.4 m -61.8 -43.02 99.68 Favored 'General case' 0 C--O 1.226 -0.182 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.194 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 40.1 m -72.44 -44.18 62.76 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 111.533 0.197 . . . . 0.0 111.533 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.687 HG23 ' O ' ' A' ' 31' ' ' LYS . 65.2 t -63.53 -48.43 86.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.229 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.44 ' HB2' ' CD1' ' A' ' 40' ' ' LEU . 68.7 m-85 -102.37 10.12 39.3 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -178.84 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.26 173.41 16.03 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.775 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.791 ' HB3' HG23 ' A' ' 33' ' ' THR . 0.0 OUTLIER -127.86 157.96 71.99 Favored Pre-proline 0 N--CA 1.464 0.229 0 O-C-N 122.814 -0.227 . . . . 0.0 110.763 179.93 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -89.34 153.3 30.54 Favored 'Cis proline' 0 C--N 1.35 0.611 0 C-N-CA 123.803 -1.332 . . . . 0.0 113.351 0.368 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.524 HD23 ' HA ' ' A' ' 81' ' ' SER . 51.9 mt -138.32 159.17 42.74 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.134 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -114.16 134.88 54.6 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.706 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.527 HD12 ' CZ ' ' A' ' 25' ' ' TYR . 50.7 mt -92.59 107.15 19.0 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.739 0.304 . . . . 0.0 110.834 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -113.78 129.58 56.56 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.279 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.562 ' HB2' HD11 ' A' ' 53' ' ' LEU . 14.8 t80 -108.27 124.3 50.11 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.477 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.0 ptm -126.18 130.83 51.77 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.855 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -89.92 -71.45 0.61 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.165 -179.525 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -142.13 -71.89 0.33 Allowed 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.553 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -117.53 16.73 14.61 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.128 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.1 mt -131.59 143.74 50.56 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.611 0.244 . . . . 0.0 110.924 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.67 126.61 54.69 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.93 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.403 HD13 ' CD1' ' A' ' 44' ' ' TYR . 3.8 mp -122.75 132.73 70.73 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.109 -179.758 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.1 tt -102.69 135.66 43.93 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.798 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.562 HD11 ' HB2' ' A' ' 44' ' ' TYR . 0.6 OUTLIER -109.13 110.22 21.41 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.914 -179.938 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.56 -36.14 9.28 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.23 179.724 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -129.72 174.06 10.05 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.07 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -56.61 -33.86 66.67 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.028 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -54.44 -46.06 73.17 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 123.277 0.36 . . . . 0.0 110.956 179.727 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -61.92 -43.9 97.88 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.804 179.506 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 22.9 tp -69.01 -37.95 78.98 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.377 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.541 ' HA ' HD12 ' A' ' 63' ' ' ILE . 1.2 t70 -61.74 -43.09 99.53 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.935 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.58 -33.72 75.59 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.971 179.466 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.552 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -62.55 -35.63 80.08 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.402 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.541 HD12 ' HA ' ' A' ' 60' ' ' ASP . 13.4 mt -65.93 -44.91 92.33 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 CA-C-O 120.642 0.258 . . . . 0.0 110.468 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -41.63 89.14 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.948 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.552 HD12 ' HA ' ' A' ' 62' ' ' ALA . 11.0 mt -67.6 -41.68 85.92 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.111 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.423 HD13 ' HG ' ' A' ' 75' ' ' LEU . 1.9 tp -59.98 -47.32 86.29 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.85 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -67.63 -36.74 81.36 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.79 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 -66.21 -27.54 68.06 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.577 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 32.6 t -58.77 147.43 33.36 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.93 0.395 . . . . 0.0 111.629 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.6 p -71.33 -31.1 66.99 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.35 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.4 t -144.28 85.85 1.81 Allowed 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.955 0.407 . . . . 0.0 110.862 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 6.6 ttt -171.07 100.87 0.21 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.09 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.13 -35.1 10.12 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.234 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.405 ' C ' HD21 ' A' ' 66' ' ' LEU . 0.4 OUTLIER -98.54 159.02 15.23 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.61 0.243 . . . . 0.0 110.771 179.735 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.423 ' HG ' HD13 ' A' ' 66' ' ' LEU . 0.1 OUTLIER -91.93 126.41 37.0 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.816 -179.979 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -86.48 86.43 7.34 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.772 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.412 HD11 ' CD2' ' A' ' 75' ' ' LEU . 30.5 mm -104.15 128.22 57.75 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.052 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -114.58 118.74 34.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.688 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.604 HD21 ' HB3' ' A' ' 8' ' ' PHE . 0.2 OUTLIER -108.18 131.9 54.18 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.456 179.773 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.1 pp -125.59 151.1 46.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.09 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' SER . . . . . 0.524 ' HA ' HD23 ' A' ' 40' ' ' LEU . 1.1 p -65.57 146.92 54.24 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.067 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 . . . . . 0 C--O 1.234 0.287 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 179.88 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 . . . . . 0 N--CA 1.467 0.416 0 CA-C-O 120.812 0.339 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.4 t -111.03 100.19 10.25 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.988 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.6 mtt180 -89.34 108.63 19.74 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.799 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.523 HG21 HD12 ' A' ' 77' ' ' ILE . 7.0 mt -106.46 134.59 47.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.216 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.9 mmtt -103.1 121.29 42.31 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.735 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -109.41 138.45 45.75 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.974 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.406 ' HG3' ' HG2' ' A' ' 14' ' ' ARG . 1.3 tt0 -119.28 126.0 50.43 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.18 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -138.04 121.0 16.59 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.608 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 59.09 31.63 21.47 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.26 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.2 -35.78 3.98 Favored Glycine 0 C--N 1.337 0.638 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.775 -179.529 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -66.99 146.35 54.47 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.871 0.367 . . . . 0.0 111.219 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.406 ' HG2' ' HG3' ' A' ' 9' ' ' GLU . 22.6 mtm105 -113.51 147.18 38.39 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.361 -179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.94 136.28 40.3 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.087 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.6 mp -116.74 118.26 58.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.906 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.6 mt -127.98 136.49 60.13 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-O 120.863 0.363 . . . . 0.0 111.313 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.6 143.83 26.36 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.249 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.584 ' CE2' HG22 ' A' ' 28' ' ' VAL . 16.3 m-85 -130.79 133.66 46.17 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.08 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.88 132.58 35.22 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.986 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.5 mtt180 -80.74 155.44 73.3 Favored Pre-proline 0 N--CA 1.464 0.226 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.087 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -72.75 124.68 9.44 Favored 'Cis proline' 0 C--N 1.349 0.579 0 C-N-CA 123.67 -1.388 . . . . 0.0 112.379 0.085 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.1 p -72.7 141.79 15.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.226 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.53 ' O ' HG23 ' A' ' 28' ' ' VAL . 11.0 mmtt -118.59 128.44 54.56 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.9 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -57.41 -36.59 71.52 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.78 179.6 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.26 -44.77 94.2 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.089 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -69.05 -44.36 72.8 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.124 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.705 ' O ' HG23 ' A' ' 32' ' ' VAL . 38.6 t -66.43 -47.47 83.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.151 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -61.47 -45.64 93.42 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.125 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -62.66 -45.2 93.91 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.723 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.751 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.4 OUTLIER -63.36 -49.34 74.26 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.408 179.921 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.705 HG23 ' O ' ' A' ' 28' ' ' VAL . 56.0 t -60.94 -42.65 93.65 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.377 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 92.1 m -61.98 -39.46 92.26 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.056 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.8 m -72.28 -41.4 66.73 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 111.6 0.222 . . . . 0.0 111.6 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.751 HG23 ' O ' ' A' ' 31' ' ' LYS . 50.7 t -60.0 -52.49 60.57 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-O 120.575 0.226 . . . . 0.0 111.545 -179.402 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -88.42 -23.24 23.37 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -179.047 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.499 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 104.25 -176.08 23.26 Favored Glycine 0 CA--C 1.523 0.588 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.371 -179.599 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -137.35 156.79 75.02 Favored Pre-proline 0 N--CA 1.466 0.349 0 CA-C-O 120.624 0.249 . . . . 0.0 111.134 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -85.85 140.17 26.64 Favored 'Cis proline' 0 C--N 1.349 0.574 0 C-N-CA 123.451 -1.479 . . . . 0.0 112.979 0.075 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.499 HD12 ' O ' ' A' ' 37' ' ' GLY . 21.8 mt -137.73 139.14 39.97 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.947 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -106.65 136.88 45.69 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.163 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 66.7 mt -86.54 108.74 18.7 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.048 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -112.23 119.96 40.13 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.899 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.402 ' HB3' ' CD2' ' A' ' 53' ' ' LEU . 10.3 t80 -106.33 130.06 54.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.562 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.1 ppp? -130.6 122.81 28.15 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.953 0.406 . . . . 0.0 110.937 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -79.12 -41.43 28.6 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.529 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -170.24 -67.18 0.02 OUTLIER 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.553 179.432 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -111.44 -24.64 10.05 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.634 179.67 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.457 HD13 ' N ' ' A' ' 50' ' ' SER . 0.2 OUTLIER -105.74 138.77 41.38 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.656 0.265 . . . . 0.0 111.328 -179.563 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.457 ' N ' HD13 ' A' ' 49' ' ' LEU . 17.0 t -110.09 131.06 55.39 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.711 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.3 mt -113.56 134.16 57.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.604 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.0 mt -84.47 118.04 24.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.034 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.562 HD13 ' CB ' ' A' ' 58' ' ' ASP . 3.4 mm? -86.33 100.0 11.99 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.312 179.513 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.6 mttt -135.22 25.22 3.53 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.932 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -173.5 157.18 3.17 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.653 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -61.09 -32.33 72.0 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.654 179.511 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.75 -45.82 81.77 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.888 179.777 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.562 ' CB ' HD13 ' A' ' 53' ' ' LEU . 8.1 m-20 -60.47 -42.29 95.95 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.814 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 13.6 tp -66.71 -42.6 86.12 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.804 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.896 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.2 OUTLIER -62.73 -38.88 92.23 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.379 179.977 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -39.93 95.67 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.804 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.99 -36.33 83.18 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.096 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.896 HD12 ' HA ' ' A' ' 60' ' ' ASP . 14.4 mt -65.18 -44.22 95.38 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.139 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.826 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -55.44 -45.78 76.77 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.082 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 10.7 mt -67.19 -40.44 85.15 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.607 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.491 HD21 ' O ' ' A' ' 73' ' ' LYS . 0.5 OUTLIER -64.0 -44.1 93.68 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.002 179.598 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -57.2 -34.58 68.65 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.183 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.2 mtp85 -73.66 -31.36 63.44 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.474 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.8 t -96.36 101.03 12.6 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.367 -179.682 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.7 t -59.74 -38.44 81.74 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.18 179.574 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 56.3 p -59.12 -36.12 74.63 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.236 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.34 149.36 30.3 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.065 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.491 ' O ' HD21 ' A' ' 66' ' ' LEU . 22.3 mttp -144.0 -47.23 0.27 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.148 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 95.4 p -101.89 167.65 9.93 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.95 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.1 mt -104.91 130.7 53.02 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.049 -179.834 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.33 81.26 8.43 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.938 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.523 HD12 HG21 ' A' ' 6' ' ' ILE . 24.3 mt -102.69 116.78 47.02 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.685 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 46.3 mt -101.95 117.34 34.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.614 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.419 HD13 HD13 ' A' ' 40' ' ' LEU . 1.8 pp -101.92 131.85 48.06 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.902 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.2 mp -129.35 155.12 46.14 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.027 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' SER . . . . . 0.468 ' HA ' HD23 ' A' ' 40' ' ' LEU . 0.4 OUTLIER -65.75 146.31 54.93 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.913 179.864 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.19 0 CA-C-N 116.266 -0.425 . . . . 0.0 112.093 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 . . . . . 0 N--CA 1.468 0.437 0 CA-C-O 120.9 0.381 . . . . 0.0 111.308 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.2 t -108.56 128.59 64.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.447 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.6 mtt180 -89.88 113.23 24.8 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.796 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.506 ' CG2' HD12 ' A' ' 77' ' ' ILE . 3.0 mt -103.34 133.83 46.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.145 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -94.13 128.54 40.6 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.757 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.508 ' HB3' HD21 ' A' ' 79' ' ' LEU . 96.8 m-85 -116.96 132.23 56.75 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.909 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.404 ' HA ' ' O ' ' A' ' 13' ' ' GLU . 1.8 mt-10 -119.09 123.46 44.5 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.04 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 -129.35 118.0 21.53 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.734 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 57.92 33.68 23.47 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.472 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.67 -29.08 9.57 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.989 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.404 ' O ' ' HA ' ' A' ' 9' ' ' GLU . 17.7 tt0 -64.79 148.3 51.51 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.707 0.289 . . . . 0.0 111.131 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.2 mtp180 -120.35 134.55 55.24 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.136 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 50.8 mtp180 -142.99 149.61 38.54 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.305 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.0 mt -114.46 133.76 59.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.242 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 23.8 mt -137.58 130.76 42.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.209 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.78 141.34 28.55 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.199 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -137.48 132.42 33.28 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.132 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.5 m -84.55 125.41 32.39 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.869 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 54.9 mtm180 -89.44 154.67 48.78 Favored Pre-proline 0 CA--C 1.529 0.155 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.116 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -74.61 121.07 6.98 Favored 'Cis proline' 0 C--N 1.351 0.663 0 C-N-CA 123.725 -1.365 . . . . 0.0 112.506 0.122 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.8 p -101.77 131.36 49.84 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.8 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp -78.28 144.56 36.03 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.825 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.514 ' CD1' HD13 ' A' ' 59' ' ' LEU . 50.8 t80 -56.77 -39.56 74.28 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.79 179.426 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.417 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -62.9 -36.01 81.95 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.15 179.696 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -67.92 -44.1 77.65 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 116.697 -0.228 . . . . 0.0 110.98 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.469 ' O ' HG23 ' A' ' 32' ' ' VAL . 31.6 t -63.84 -47.33 91.26 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.956 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.417 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 13.0 pt-20 -66.75 -35.08 79.27 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.085 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -56.43 -45.39 80.77 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.628 0.251 . . . . 0.0 110.852 179.531 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.662 ' O ' HG23 ' A' ' 35' ' ' VAL . 5.4 mmmt -68.25 -49.26 61.82 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.91 179.66 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 28' ' ' VAL . 40.1 t -61.25 -40.67 86.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.477 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.501 HG23 ' HB3' ' A' ' 38' ' ' GLN . 98.1 m -66.45 -41.72 88.67 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.069 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.3 m -72.63 -43.53 63.11 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 111.68 0.252 . . . . 0.0 111.68 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.662 HG23 ' O ' ' A' ' 31' ' ' LYS . 60.7 t -66.28 -44.06 91.33 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -179.304 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.535 ' HB2' HD11 ' A' ' 40' ' ' LEU . 18.0 m-85 -103.46 10.88 37.03 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -179.081 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.02 171.16 10.76 Favored Glycine 0 C--N 1.338 0.673 0 C-N-CA 120.736 -0.745 . . . . 0.0 113.057 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.501 ' HB3' HG23 ' A' ' 33' ' ' THR . 2.2 pt20 -120.29 159.19 48.65 Favored Pre-proline 0 N--CA 1.466 0.337 0 O-C-N 122.821 -0.223 . . . . 0.0 110.785 179.565 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -89.05 153.69 32.31 Favored 'Cis proline' 0 C--N 1.351 0.662 0 C-N-CA 123.846 -1.314 . . . . 0.0 113.477 0.459 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.535 HD11 ' HB2' ' A' ' 36' ' ' PHE . 48.3 mt -138.19 133.17 32.92 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.977 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.443 ' OD1' HD11 ' A' ' 52' ' ' LEU . 1.6 t0 -105.77 134.78 48.34 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.808 179.507 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.2 102.71 14.75 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.146 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.426 ' HA ' HD12 ' A' ' 52' ' ' LEU . 0.8 OUTLIER -101.5 122.12 43.22 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.229 -179.723 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.754 ' HB2' HD11 ' A' ' 53' ' ' LEU . 10.9 t80 -103.78 130.52 51.32 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.725 179.581 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 8.3 mtt -117.22 124.12 48.3 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.623 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -84.92 -61.92 1.66 Allowed 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.225 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -164.12 -64.12 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.694 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -112.83 -13.38 13.19 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.524 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.7 tp -120.44 143.76 48.32 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-O 120.69 0.281 . . . . 0.0 111.319 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.4 m -100.89 124.71 46.98 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.751 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.4 mt -118.59 133.51 65.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.001 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.589 HD23 ' HE2' ' A' ' 54' ' ' LYS . 14.1 tp -103.38 134.5 46.65 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.84 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.754 HD11 ' HB2' ' A' ' 44' ' ' TYR . 3.6 mp -84.89 84.31 7.75 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.751 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.589 ' HE2' HD23 ' A' ' 52' ' ' LEU . 67.5 mttm -90.28 -35.11 15.47 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.207 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -120.86 159.65 25.06 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.914 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.5 tm0? -60.16 -33.75 72.61 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.962 179.72 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.57 -40.61 79.32 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.093 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.67 -42.72 97.63 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.778 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.528 HD12 ' CD2' ' A' ' 53' ' ' LEU . 3.8 tp -68.46 -40.06 81.18 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.953 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.424 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.8 OUTLIER -61.33 -43.38 98.96 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.075 179.913 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.68 -35.74 79.39 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.85 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.64 -40.21 96.31 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.542 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.424 HD12 ' HA ' ' A' ' 60' ' ' ASP . 13.8 mt -64.16 -41.17 91.59 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 116.732 -0.213 . . . . 0.0 111.008 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -54.84 -40.13 69.29 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.028 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 44.4 mt -67.85 -42.01 85.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.811 179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.4 tp -65.54 -45.88 81.73 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.729 179.518 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.56 -39.63 77.12 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.105 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.1 mmt-85 -61.93 -34.37 75.96 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.213 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 42.5 t -84.8 105.26 15.45 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.907 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 85.6 p -67.59 -32.16 72.72 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.017 179.485 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.2 t -67.32 -43.14 82.35 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.953 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.42 120.98 25.68 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.103 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.46 -40.09 4.74 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.185 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 53.6 p -91.6 167.51 12.16 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.66 -0.246 . . . . 0.0 111.111 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.453 HD22 HD11 ' A' ' 77' ' ' ILE . 0.2 OUTLIER -107.57 131.12 54.69 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.23 -179.966 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -91.41 86.8 6.2 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.69 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.506 HD12 ' CG2' ' A' ' 6' ' ' ILE . 29.4 mt -117.95 129.3 74.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.004 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.99 117.58 32.44 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.836 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.508 HD21 ' HB3' ' A' ' 8' ' ' PHE . 0.5 OUTLIER -99.0 131.04 45.34 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.97 179.962 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 pp -122.93 130.57 53.0 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.705 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' SER . . . . . 0.421 ' HA ' HD23 ' A' ' 40' ' ' LEU . 39.4 t -75.99 135.7 40.0 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.767 179.734 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 34.8 tp60 . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.989 179.659 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.233 0.208 0 CA-C-O 121.006 0.432 . . . . 0.0 110.498 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 38.2 t -77.68 128.89 37.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.584 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 23.2 mtm180 -93.14 115.59 28.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.805 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.564 HD12 ' CD1' ' A' ' 19' ' ' PHE . 24.7 mt -108.31 128.68 63.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.856 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 39.4 mttt -106.23 126.99 52.9 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.009 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.416 ' HD1' HD23 ' A' ' 79' ' ' LEU . 89.2 m-85 -114.43 143.28 45.17 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.083 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -128.02 127.99 44.18 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.997 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.0 t-160 -143.1 118.88 10.51 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.602 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 58.4 37.29 25.79 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.345 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 91.57 -47.14 2.78 Favored Glycine 0 C--N 1.334 0.437 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.719 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.49 141.14 52.0 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.733 0.301 . . . . 0.0 110.92 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -125.06 149.75 47.49 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.323 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.51 139.46 50.5 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.948 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.4 mp -99.73 133.23 43.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.954 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 9.1 tp -129.46 137.58 56.51 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.395 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.87 131.38 35.83 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.994 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.745 ' CE2' HG22 ' A' ' 28' ' ' VAL . 6.6 m-85 -132.34 125.81 31.77 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.228 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.4 m -98.86 142.84 29.87 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.882 179.617 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 68.4 mtt180 -74.02 151.15 88.32 Favored Pre-proline 0 N--CA 1.464 0.245 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.948 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.75 125.87 12.47 Favored 'Cis proline' 0 C--N 1.352 0.715 0 C-N-CA 123.474 -1.469 . . . . 0.0 112.658 0.035 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.468 ' O ' HG13 ' A' ' 23' ' ' VAL . 11.9 p -89.61 114.94 28.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.077 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.592 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -99.66 137.16 38.53 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.106 -179.55 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.438 ' HD1' HD22 ' A' ' 59' ' ' LEU . 72.7 t80 -56.47 -40.31 74.64 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.141 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -63.57 -44.75 93.17 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.101 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -66.36 -44.28 83.62 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.374 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.745 HG22 ' CE2' ' A' ' 19' ' ' PHE . 43.1 t -65.35 -47.66 86.19 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.721 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -59.89 -42.66 94.31 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.095 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.82 -42.4 79.53 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.056 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.791 ' O ' HG23 ' A' ' 35' ' ' VAL . 13.9 mtpt -69.49 -49.63 52.92 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.028 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.547 HG23 ' O ' ' A' ' 28' ' ' VAL . 34.9 t -61.3 -40.55 86.49 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.441 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.498 HG23 ' HB3' ' A' ' 38' ' ' GLN . 88.5 m -59.3 -41.73 89.69 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.844 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 48.7 m -72.13 -31.76 66.3 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 111.464 0.172 . . . . 0.0 111.464 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 31' ' ' LYS . 48.1 t -63.95 -55.88 19.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 111.632 0.234 . . . . 0.0 111.632 -179.6 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.63 ' HB2' HD11 ' A' ' 40' ' ' LEU . 77.7 m-85 -97.56 -10.66 24.8 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 -178.793 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.97 -172.41 24.55 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.475 -179.551 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.498 ' HB3' HG23 ' A' ' 33' ' ' THR . 1.4 pt20 -143.65 156.81 59.6 Favored Pre-proline 0 N--CA 1.465 0.277 0 O-C-N 122.83 -0.218 . . . . 0.0 111.338 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -81.44 153.31 80.08 Favored 'Cis proline' 0 C--N 1.35 0.636 0 C-N-CA 123.803 -1.332 . . . . 0.0 112.884 0.234 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.63 HD11 ' HB2' ' A' ' 36' ' ' PHE . 48.0 mt -136.01 149.08 48.69 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.029 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -116.0 120.23 38.47 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.793 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.434 HD12 ' OH ' ' A' ' 25' ' ' TYR . 73.2 mt -81.95 97.29 8.01 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.727 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -97.9 113.71 25.61 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.286 -179.562 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.752 ' HB2' HD11 ' A' ' 53' ' ' LEU . 14.1 t80 -98.85 123.56 43.19 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.717 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.4 mtt -126.23 131.86 51.85 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.673 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -76.91 -43.92 33.73 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.631 179.704 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -173.93 -49.85 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.605 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -119.34 -36.58 3.33 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.375 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.8 mp -95.26 134.14 38.36 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.827 0.346 . . . . 0.0 111.24 -179.553 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 98.1 p -105.04 121.2 43.29 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.844 179.696 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.4 mt -114.75 132.49 63.77 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.86 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.546 HD23 ' N ' ' A' ' 53' ' ' LEU . 4.9 tt -88.26 132.91 34.2 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.658 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.752 HD11 ' HB2' ' A' ' 44' ' ' TYR . 2.4 mt -103.01 94.67 5.67 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.69 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.532 ' HD2' HD22 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -110.07 27.66 9.38 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.486 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -173.45 164.92 4.65 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.919 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.42 -37.15 86.53 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.548 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -58.51 -40.9 84.16 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.653 -0.249 . . . . 0.0 110.909 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.551 ' HB3' HD23 ' A' ' 53' ' ' LEU . 20.3 m-20 -65.79 -43.79 87.67 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.781 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.579 HD12 HD13 ' A' ' 53' ' ' LEU . 7.2 tp -67.21 -41.76 85.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.802 179.401 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.593 ' HA ' HD12 ' A' ' 63' ' ' ILE . 5.4 t70 -63.85 -43.1 97.16 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.932 179.706 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.4 tttm -63.87 -32.13 73.54 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.411 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.77 -40.38 97.09 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.389 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.593 HD12 ' HA ' ' A' ' 60' ' ' ASP . 5.0 mt -64.42 -40.92 90.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.935 179.642 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -55.32 -34.95 64.62 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.001 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 41.7 mt -65.96 -40.92 88.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.085 179.608 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.593 HD22 HD21 ' A' ' 75' ' ' LEU . 12.4 tp -65.33 -45.02 85.93 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.768 179.578 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -56.97 -39.42 74.57 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.608 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -65.05 -32.76 74.64 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.203 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.5 t -70.04 146.5 50.95 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.809 0.338 . . . . 0.0 111.278 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 2.3 m -76.3 -34.82 59.06 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.426 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.3 p -77.79 -52.23 9.24 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.285 -179.476 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 13.9 ptt? 40.56 86.46 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.547 0 O-C-N 123.484 0.49 . . . . 0.0 112.223 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.09 82.78 2.07 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.961 0.41 . . . . 0.0 111.173 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.562 ' C ' HD22 ' A' ' 75' ' ' LEU . 0.4 OUTLIER 63.28 -179.37 0.15 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.44 179.856 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.593 HD21 HD22 ' A' ' 66' ' ' LEU . 3.5 mm? -122.31 122.47 39.15 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.077 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.3 mtt180 -83.4 93.81 7.84 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.004 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.3 mt -109.06 128.09 65.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.869 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.5 mp -103.64 126.45 50.79 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.192 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.416 HD23 ' HD1' ' A' ' 8' ' ' PHE . 3.8 pp -111.13 136.22 50.5 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.786 0.327 . . . . 0.0 111.169 179.706 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.1 mp -128.95 155.38 45.42 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.976 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' SER . . . . . 0.63 ' HA ' HD23 ' A' ' 40' ' ' LEU . 0.9 OUTLIER -85.9 141.44 29.57 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.162 179.916 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.466 0.328 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.995 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.402 0 CA-C-O 120.951 0.405 . . . . 0.0 111.064 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.8 t -84.27 124.42 39.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.033 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.447 ' HG3' ' HB2' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -92.36 117.44 29.91 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.858 179.89 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.401 ' CG2' HD12 ' A' ' 77' ' ' ILE . 2.3 mt -103.64 130.42 54.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.12 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 tmtt? -110.55 114.42 27.82 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.711 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 12.2 p90 -113.34 146.96 38.58 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.079 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -124.48 143.95 50.37 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.106 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -140.39 111.84 7.3 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.678 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 54.58 34.49 21.4 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.645 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 104.75 -42.48 1.89 Allowed Glycine 0 C--N 1.334 0.459 0 C-N-CA 120.921 -0.657 . . . . 0.0 112.741 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.55 135.46 56.02 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.689 0.28 . . . . 0.0 111.076 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -115.05 154.08 29.52 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.596 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -151.79 136.37 16.98 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.157 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.42 ' O ' HD13 ' A' ' 17' ' ' ILE . 25.7 mt -114.38 126.56 71.94 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.135 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.42 HD13 ' O ' ' A' ' 16' ' ' ILE . 26.2 mm -130.63 131.13 64.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.12 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.447 ' HB2' ' HG3' ' A' ' 5' ' ' ARG . . . -95.66 134.05 39.01 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.13 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.44 ' CE2' HG13 ' A' ' 28' ' ' VAL . 9.5 m-85 -126.94 124.19 38.92 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.201 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -80.87 150.26 29.15 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.052 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.499 ' HD2' HG12 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -91.42 152.01 43.26 Favored Pre-proline 0 CA--C 1.532 0.274 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.256 179.995 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -76.04 131.3 23.82 Favored 'Cis proline' 0 C--N 1.35 0.629 0 C-N-CA 123.233 -1.57 . . . . 0.0 112.318 -0.06 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.499 HG12 ' HD2' ' A' ' 21' ' ' ARG . 14.9 p -119.96 123.55 71.04 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.043 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.443 ' O ' HG23 ' A' ' 28' ' ' VAL . 39.7 mttp -91.79 151.09 20.76 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.08 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -62.65 -35.99 81.42 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.895 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -63.37 -44.66 94.14 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.987 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.67 -44.4 93.88 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.392 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 24' ' ' LYS . 39.4 t -67.73 -47.62 79.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 120.777 0.322 . . . . 0.0 110.685 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -63.42 -44.5 94.42 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.36 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -56.33 -39.04 72.17 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.471 -179.721 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.791 ' O ' HG23 ' A' ' 35' ' ' VAL . 6.7 tttt -64.13 -47.58 79.39 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-O 120.64 0.257 . . . . 0.0 110.556 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 28' ' ' VAL . 20.7 t -63.52 -40.25 88.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.691 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.641 HG22 ' HG3' ' A' ' 38' ' ' GLN . 0.1 OUTLIER -59.28 -40.69 86.91 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 116.856 -0.156 . . . . 0.0 111.112 -179.932 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.9 m -72.47 -33.25 66.87 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.436 0.16 . . . . 0.0 111.088 179.29 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 31' ' ' LYS . 44.7 t -68.03 -53.1 32.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.485 ' HB2' HD11 ' A' ' 40' ' ' LEU . 30.6 m-85 -99.85 9.12 43.52 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -179.124 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.86 176.46 26.41 Favored Glycine 0 C--N 1.335 0.524 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.877 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.641 ' HG3' HG22 ' A' ' 33' ' ' THR . 1.3 mt-30 -124.35 158.54 60.95 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-O 120.467 0.175 . . . . 0.0 110.944 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -90.07 153.51 27.53 Favored 'Cis proline' 0 C--N 1.348 0.526 0 C-N-CA 123.901 -1.291 . . . . 0.0 113.175 0.442 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.578 HD23 ' HA ' ' A' ' 81' ' ' SER . 78.1 mt -138.54 148.35 44.14 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.942 179.573 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -115.16 123.58 49.28 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.663 179.412 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.548 HD23 ' HB3' ' A' ' 79' ' ' LEU . 81.1 mt -88.32 102.01 14.44 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.182 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -96.59 122.01 39.05 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.024 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.647 ' CZ ' ' HB1' ' A' ' 62' ' ' ALA . 15.2 t80 -104.3 119.04 38.07 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.47 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 27.6 mmm -94.32 130.97 40.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.768 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -82.5 -50.39 8.89 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.874 0.369 . . . . 0.0 110.348 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -172.41 -63.51 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.009 179.613 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -107.14 -28.95 9.65 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.485 179.628 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.6 mt -109.12 162.98 13.75 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.919 0.39 . . . . 0.0 111.525 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.24 125.39 53.04 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.186 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.6 mm -116.61 132.7 65.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.944 179.775 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.495 HD12 ' O ' ' A' ' 42' ' ' LEU . 37.6 tp -94.75 126.55 40.14 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.841 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.444 HD21 ' CB ' ' A' ' 44' ' ' TYR . 15.6 mt -79.93 131.67 35.88 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.727 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.4 mmtt -108.04 -38.39 5.8 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.393 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 39.3 p30 -152.78 -172.3 4.2 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.041 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -55.98 -36.35 67.77 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.974 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.73 -44.99 70.35 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.859 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.64 -35.38 80.63 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.871 179.446 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.5 tp -72.91 -38.37 66.92 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.145 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -62.28 -43.38 98.96 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.263 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.3 ptpt -69.23 -30.77 68.99 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.808 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.647 ' HB1' ' CZ ' ' A' ' 44' ' ' TYR . . . -63.24 -39.4 94.49 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.294 179.751 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 21.6 mt -62.95 -40.89 90.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.838 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -55.82 -38.42 69.98 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.082 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 31.9 mm -68.77 -38.02 78.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.96 179.557 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.3 tp -62.28 -36.95 83.67 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.027 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.425 ' HA ' ' HG3' ' A' ' 72' ' ' MET . 14.6 t70 -57.9 -36.89 73.06 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.956 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 9.2 mtt-85 -65.74 -32.38 73.9 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.833 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 26.2 t -68.66 165.06 20.16 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.147 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.95 -37.73 38.85 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.861 -179.72 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.82 -69.75 0.27 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.649 -0.251 . . . . 0.0 111.483 -179.295 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.425 ' HG3' ' HA ' ' A' ' 67' ' ' ASP . 2.0 ttm 53.83 30.49 11.47 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 120.759 0.314 . . . . 0.0 111.422 -179.711 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.7 mmpt? -117.8 -31.25 5.19 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.687 -0.233 . . . . 0.0 111.28 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.2 p -126.53 165.57 18.88 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.928 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.505 HD12 ' HE2' ' A' ' 44' ' ' TYR . 2.7 mm? -113.5 122.25 46.7 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.626 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.2 mtt-85 -82.95 93.62 7.57 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 120.837 0.351 . . . . 0.0 110.762 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.401 HD12 ' CG2' ' A' ' 6' ' ' ILE . 17.2 mt -126.11 131.43 71.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.133 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.8 tp -115.27 117.04 29.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.522 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.548 ' HB3' HD23 ' A' ' 42' ' ' LEU . 3.8 pp -110.57 135.41 51.25 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.768 0.318 . . . . 0.0 110.952 179.765 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.1 mt -135.74 154.14 51.34 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.677 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' SER . . . . . 0.578 ' HA ' HD23 ' A' ' 40' ' ' LEU . 6.2 t -89.67 145.07 25.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.984 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.277 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 . . . . . 0 N--CA 1.466 0.355 0 CA-C-O 120.809 0.338 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.412 HG23 ' HG3' ' A' ' 21' ' ' ARG . 19.2 t -108.56 123.7 64.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.334 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.91 106.62 18.52 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.594 179.687 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 23.0 mt -107.09 124.69 63.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.123 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.413 ' HG2' ' HA ' ' A' ' 76' ' ' ARG . 0.0 OUTLIER -101.6 116.98 33.96 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.764 179.544 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.61 ' CD1' HD23 ' A' ' 79' ' ' LEU . 20.5 m-85 -104.27 139.92 38.59 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.943 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.528 ' HB3' HD12 ' A' ' 78' ' ' LEU . 1.0 OUTLIER -123.37 132.25 53.91 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.95 -179.991 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -142.12 117.05 9.92 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.786 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 57.97 35.62 25.44 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.335 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.06 -35.46 4.17 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.839 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -64.8 135.99 56.4 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.737 0.268 . . . . 0.0 110.932 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -117.35 140.18 49.9 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.22 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 25.1 mtt-85 -148.25 136.4 21.16 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.234 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.5 mt -105.14 125.04 60.24 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.233 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 26.0 mm -115.78 133.08 63.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.104 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.4 132.16 37.91 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.104 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -128.01 146.03 50.79 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.196 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.52 141.73 28.41 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.998 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.412 ' HG3' HG23 ' A' ' 4' ' ' VAL . 12.8 mtm180 -98.2 138.6 20.9 Favored Pre-proline 0 C--O 1.233 0.192 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.017 179.686 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -75.14 146.93 87.8 Favored 'Cis proline' 0 C--N 1.35 0.615 0 C-N-CA 123.773 -1.345 . . . . 0.0 112.446 0.061 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.415 HG13 ' O ' ' A' ' 23' ' ' VAL . 12.4 p -117.56 121.03 66.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 120.918 0.39 . . . . 0.0 111.008 179.788 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.423 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -75.58 130.62 39.1 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.875 -179.97 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.41 ' OH ' HD13 ' A' ' 42' ' ' LEU . 74.9 t80 -55.31 -35.76 65.48 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.983 179.501 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -60.72 -42.37 97.14 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.879 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -67.91 -43.12 79.96 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.919 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.663 ' O ' HG23 ' A' ' 32' ' ' VAL . 21.2 t -61.96 -47.02 95.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.95 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.443 ' HG3' ' N ' ' A' ' 30' ' ' HIS . 10.5 pt-20 -65.72 -42.27 91.26 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.927 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.443 ' N ' ' HG3' ' A' ' 29' ' ' GLU . 0.8 OUTLIER -56.47 -42.48 78.3 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.233 -179.971 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.823 ' O ' HG23 ' A' ' 35' ' ' VAL . 11.9 tttt -70.25 -49.16 52.72 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.051 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.663 HG23 ' O ' ' A' ' 28' ' ' VAL . 24.4 t -63.19 -40.75 90.22 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.388 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.724 HG23 ' HB3' ' A' ' 38' ' ' GLN . 60.3 m -58.56 -42.56 88.23 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.057 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.1 m -72.31 -35.29 68.61 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 120.484 0.183 . . . . 0.0 111.452 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.823 HG23 ' O ' ' A' ' 31' ' ' LYS . 49.1 t -67.69 -50.71 58.13 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -179.5 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.409 ' HB2' ' CD1' ' A' ' 40' ' ' LEU . 18.4 m-85 -103.97 10.92 36.01 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -179.05 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.63 172.4 9.39 Favored Glycine 0 CA--C 1.523 0.545 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.906 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.724 ' HB3' HG23 ' A' ' 33' ' ' THR . 5.1 pt20 -128.63 158.82 70.81 Favored Pre-proline 0 N--CA 1.463 0.213 0 CA-C-O 120.457 0.17 . . . . 0.0 110.709 179.571 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -87.57 153.88 41.46 Favored 'Cis proline' 0 C--N 1.35 0.638 0 C-N-CA 123.834 -1.319 . . . . 0.0 113.441 0.555 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.538 HD13 HD13 ' A' ' 79' ' ' LEU . 47.6 mt -138.93 155.69 47.84 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.703 179.637 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -114.54 134.12 55.27 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.842 0.353 . . . . 0.0 110.83 179.223 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.41 HD13 ' OH ' ' A' ' 25' ' ' TYR . 5.4 mp -91.39 103.75 16.35 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.943 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.413 ' CD2' ' HB2' ' A' ' 50' ' ' SER . 0.1 OUTLIER -111.15 122.18 47.22 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.337 -179.552 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.772 ' HB3' HD11 ' A' ' 53' ' ' LEU . 13.4 t80 -124.32 130.52 52.66 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.699 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.43 133.14 49.97 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.799 179.473 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -63.74 -56.23 17.21 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.735 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -157.43 -53.94 0.07 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.583 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -127.04 7.79 6.64 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.522 179.459 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.2 mt -131.39 138.65 49.21 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.474 0.178 . . . . 0.0 110.895 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.413 ' HB2' ' CD2' ' A' ' 43' ' ' HIS . 29.9 p -110.33 131.62 54.89 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.964 179.718 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 24.4 mt -130.28 134.62 62.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.974 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.8 133.55 33.98 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.925 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.772 HD11 ' HB3' ' A' ' 44' ' ' TYR . 0.2 OUTLIER -126.26 87.98 2.76 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.773 179.916 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -109.12 26.72 10.3 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.988 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -154.7 154.16 32.44 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.774 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.0 tp60 -60.55 -34.03 73.55 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.853 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -59.7 -50.63 73.12 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.02 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.05 -42.91 99.68 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.841 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 15.1 tp -60.93 -40.75 94.4 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.01 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.578 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.3 OUTLIER -61.63 -41.53 97.61 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.908 179.744 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 15.6 mtpt -63.5 -36.84 85.08 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.77 -36.45 83.13 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.106 179.637 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.578 HD12 ' HA ' ' A' ' 60' ' ' ASP . 39.3 mt -60.16 -44.01 94.33 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.962 179.82 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -54.4 -41.31 69.13 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.967 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 46.2 mt -65.18 -46.21 91.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.019 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.1 mt -63.06 -39.35 94.47 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.914 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -57.99 -37.33 74.05 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.11 179.52 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.3 mmt180 -62.25 -35.13 78.01 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.206 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 33.1 t -88.76 112.19 22.89 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.123 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.2 m -72.6 -33.72 66.91 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.898 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.7 p -74.82 -37.08 62.4 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.491 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -90.37 111.92 23.33 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.085 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.6 pttt -126.41 32.17 5.24 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.932 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 61.4 p -146.64 153.64 40.54 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.121 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.5 mp -104.07 116.76 32.81 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.12 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.413 ' HA ' ' HG2' ' A' ' 7' ' ' LYS . 6.4 ttm180 -90.17 91.86 8.71 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.698 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.8 mt -110.31 122.75 65.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.004 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.528 HD12 ' HB3' ' A' ' 9' ' ' GLU . 0.8 OUTLIER -105.83 117.56 34.34 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.767 179.773 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.61 HD23 ' CD1' ' A' ' 8' ' ' PHE . 3.6 pp -109.38 133.22 53.33 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.788 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.1 pp -118.07 154.62 31.76 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.841 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' SER . . . . . 0.444 ' HA ' HD23 ' A' ' 40' ' ' LEU . 25.9 m -97.06 135.57 38.86 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.76 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.285 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.584 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.414 ' OD1' ' HB1' ' A' ' 18' ' ' ALA . 3.7 t70 . . . . . 0 N--CA 1.466 0.366 0 CA-C-O 121.043 0.449 . . . . 0.0 111.207 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.4 t -128.32 137.77 56.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.152 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.55 116.08 28.49 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.432 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.698 HD13 ' HD2' ' A' ' 19' ' ' PHE . 4.0 mp -117.67 131.15 71.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.974 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 26.6 tttt -106.63 129.18 54.59 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.929 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -114.73 134.41 55.12 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.881 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.407 ' HB3' HD13 ' A' ' 78' ' ' LEU . 3.4 tt0 -119.21 123.85 45.33 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.962 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.4 t-160 -134.81 115.9 14.2 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.624 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 57.93 32.53 22.07 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.301 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 96.06 -34.77 4.72 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.995 -0.622 . . . . 0.0 112.699 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -65.02 136.41 56.75 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.703 0.287 . . . . 0.0 110.932 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 40.9 mtm-85 -108.61 138.78 44.36 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.158 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -132.81 127.83 35.39 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.798 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.8 mp -110.39 123.95 66.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.923 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 33.6 mt -137.44 131.81 44.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 121.029 0.442 . . . . 0.0 111.034 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.414 ' HB1' ' OD1' ' A' ' 3' ' ' ASP . . . -92.03 134.04 35.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.696 -0.683 . . . . 0.0 111.122 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.698 ' HD2' HD13 ' A' ' 6' ' ' ILE . 11.6 m-85 -116.21 119.26 35.2 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.767 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 93.2 p -74.9 131.18 40.51 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.912 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.3 mtm180 -73.95 151.78 88.6 Favored Pre-proline 0 N--CA 1.463 0.223 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.288 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.14 166.18 82.93 Favored 'Cis proline' 0 C--N 1.351 0.668 0 C-N-CA 123.562 -1.433 . . . . 0.0 112.845 0.132 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.5 p -152.63 153.17 9.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.239 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.551 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -134.31 164.17 28.01 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.491 -179.698 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.462 ' CD2' HD22 ' A' ' 59' ' ' LEU . 6.7 t80 -56.92 -44.65 82.66 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.264 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -58.09 -45.15 87.65 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.396 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.41 ' HB2' ' HG2' ' A' ' 24' ' ' LYS . 2.8 t70 -67.03 -44.42 80.28 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.572 -179.552 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.551 HG23 ' O ' ' A' ' 24' ' ' LYS . 40.0 t -67.9 -46.99 81.01 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.065 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -63.45 -41.49 98.65 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.388 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.6 m80 -56.68 -40.89 76.37 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.641 0.258 . . . . 0.0 111.059 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.797 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.4 OUTLIER -69.78 -49.07 56.44 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.257 -179.962 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 46.4 t -65.39 -42.57 93.83 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 CA-C-N 116.693 -0.231 . . . . 0.0 111.516 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.41 HG23 ' HB3' ' A' ' 38' ' ' GLN . 75.0 m -59.06 -39.67 82.79 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.725 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 29.7 m -72.15 -32.47 66.92 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 121.247 -0.181 . . . . 0.0 111.331 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.797 HG23 ' O ' ' A' ' 31' ' ' LYS . 60.4 t -66.87 -58.28 7.01 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 N-CA-C 111.435 0.161 . . . . 0.0 111.435 -179.652 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.493 ' HB2' HD11 ' A' ' 40' ' ' LEU . 33.0 m-85 -95.85 6.78 48.07 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -179.157 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.506 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 80.09 -176.29 54.72 Favored Glycine 0 C--N 1.336 0.546 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.693 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.41 ' HB3' HG23 ' A' ' 33' ' ' THR . 0.4 OUTLIER -131.28 155.87 80.91 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 120.561 0.22 . . . . 0.0 111.068 -179.9 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -90.61 153.72 25.34 Favored 'Cis proline' 0 C--N 1.349 0.601 0 C-N-CA 123.744 -1.357 . . . . 0.0 113.273 0.28 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.506 HD12 ' O ' ' A' ' 37' ' ' GLY . 21.5 mt -137.41 141.79 41.67 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.933 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -114.33 127.63 55.95 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.936 179.654 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 21.0 mt -92.66 112.84 24.94 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.829 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -110.54 120.65 43.11 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.156 -179.767 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.873 ' HB2' HD21 ' A' ' 53' ' ' LEU . 1.2 t80 -88.76 130.33 35.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.842 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.6 mpp? -126.93 113.96 17.21 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.547 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -72.77 -53.98 10.13 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.733 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -176.68 -56.62 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.343 179.78 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -107.21 -26.79 10.91 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.536 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.487 HD23 ' N ' ' A' ' 50' ' ' SER . 0.9 OUTLIER -114.04 155.61 25.62 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.882 0.372 . . . . 0.0 111.495 -179.576 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.487 ' N ' HD23 ' A' ' 49' ' ' LEU . 0.7 OUTLIER -118.12 124.94 49.25 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.839 179.624 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 9.6 mt -113.87 133.12 60.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.046 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.84 135.87 38.2 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.806 179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.873 HD21 ' HB2' ' A' ' 44' ' ' TYR . 1.0 OUTLIER -95.33 76.68 3.4 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.617 179.915 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 3.0 pttp -77.37 -35.34 54.59 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.489 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -123.14 165.06 17.48 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.075 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.8 tm0? -59.94 -35.86 75.82 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.807 179.289 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -53.81 -49.88 67.37 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.91 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -59.17 -46.0 89.55 Favored 'General case' 0 N--CA 1.461 0.125 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.148 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.462 HD22 ' CD2' ' A' ' 25' ' ' TYR . 6.3 tp -66.15 -41.86 89.83 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.885 179.567 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.833 ' HA ' HD12 ' A' ' 63' ' ' ILE . 11.1 t0 -66.27 -42.34 88.62 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.395 -179.616 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -62.75 -36.52 83.31 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.45 179.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.816 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -63.81 -39.14 93.52 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.205 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.833 HD12 ' HA ' ' A' ' 60' ' ' ASP . 8.2 mt -64.53 -42.78 96.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.798 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.11 -37.69 67.18 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.945 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.816 HD12 ' HA ' ' A' ' 62' ' ' ALA . 9.5 mt -65.86 -41.69 90.6 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.879 179.657 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.497 HD13 HD12 ' A' ' 75' ' ' LEU . 5.9 tt -61.42 -44.21 97.53 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.865 179.541 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.79 -34.41 78.28 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.076 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -67.32 -32.63 73.72 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.406 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.7 t -103.92 109.05 20.66 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.294 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 47.5 t -77.7 -9.17 58.84 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.3 p -89.65 42.53 1.1 Allowed 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 120.758 0.313 . . . . 0.0 111.66 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.81 -173.67 3.63 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.691 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.7 mttm -130.87 -69.05 0.66 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.652 0.263 . . . . 0.0 111.012 179.824 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -130.52 -173.01 2.95 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.058 -179.677 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.497 HD12 HD13 ' A' ' 66' ' ' LEU . 1.9 mp -91.9 121.54 33.59 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.452 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.9 tpt180 -76.81 80.34 3.41 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.002 0.429 . . . . 0.0 110.74 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.549 HD12 ' CG2' ' A' ' 6' ' ' ILE . 26.5 mt -103.93 123.24 57.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.754 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.407 HD13 ' HB3' ' A' ' 9' ' ' GLU . 4.0 mm? -103.29 117.29 34.17 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.819 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.1 pp -105.7 127.77 53.27 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.568 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.3 mp -119.82 127.62 52.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.127 -179.51 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -98.2 131.17 44.78 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.986 179.616 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.354 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.49 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 . . . . . 0 N--CA 1.466 0.341 0 CA-C-O 120.901 0.381 . . . . 0.0 110.87 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 23.2 t -78.48 130.08 36.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.348 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -87.76 123.58 32.71 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.928 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 3.1 mt -118.06 124.53 73.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.643 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.7 mttp -95.07 121.24 36.5 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.796 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -113.15 131.72 55.74 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.689 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.634 ' HB2' HD12 ' A' ' 78' ' ' LEU . 0.6 OUTLIER -119.22 127.91 53.71 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.182 -179.826 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 12.9 t-160 -130.98 117.19 18.84 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.522 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 56.33 32.27 20.16 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.548 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 96.26 -28.08 14.43 Favored Glycine 0 C--N 1.335 0.508 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.012 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.5 148.19 52.15 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.829 0.347 . . . . 0.0 111.273 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.7 ptp85 -109.07 142.59 39.56 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.113 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -141.87 139.95 32.76 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.227 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.1 mp -115.38 131.72 66.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.233 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.739 HD13 ' N ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -145.34 131.38 14.15 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.237 -179.944 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.739 ' N ' HD13 ' A' ' 17' ' ' ILE . . . -103.88 127.68 51.38 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.059 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.649 ' CD2' HD12 ' A' ' 17' ' ' ILE . 5.1 m-85 -113.28 120.7 42.09 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.087 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.3 m -82.55 128.53 34.39 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.931 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.0 mtm180 -78.33 156.8 78.53 Favored Pre-proline 0 N--CA 1.464 0.233 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.912 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.68 126.37 12.89 Favored 'Cis proline' 0 C--N 1.351 0.667 0 C-N-CA 123.566 -1.431 . . . . 0.0 112.667 -0.147 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.1 p -103.25 147.05 10.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.454 -179.76 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.412 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -110.66 146.11 36.77 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.109 -179.909 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -59.68 -39.6 85.04 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.629 179.258 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -43.83 98.14 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.837 179.682 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -64.96 -44.34 89.7 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.425 -179.793 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.673 ' O ' HG23 ' A' ' 32' ' ' VAL . 43.1 t -68.18 -47.3 78.89 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.125 0 CA-C-O 120.605 0.24 . . . . 0.0 111.156 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.435 ' HG3' HD11 ' A' ' 42' ' ' LEU . 1.4 tt0 -64.28 -45.45 87.98 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.136 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -58.95 -44.36 91.43 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.752 0.31 . . . . 0.0 110.596 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.721 ' O ' HG23 ' A' ' 35' ' ' VAL . 1.2 tttt -64.05 -49.47 72.23 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.228 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.673 HG23 ' O ' ' A' ' 28' ' ' VAL . 43.6 t -64.09 -41.05 91.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-N 116.764 -0.198 . . . . 0.0 111.323 -179.621 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 95.9 m -61.34 -39.5 90.79 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.993 179.78 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.3 m -72.42 -40.97 66.73 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 121.137 -0.225 . . . . 0.0 111.344 179.585 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.721 HG23 ' O ' ' A' ' 31' ' ' LYS . 47.3 t -64.84 -55.1 22.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.173 0 CA-C-O 120.67 0.271 . . . . 0.0 111.353 -179.531 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -85.95 -7.45 58.66 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -179.23 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.411 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 86.03 177.15 50.01 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.571 -179.798 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.94 154.43 79.22 Favored Pre-proline 0 N--CA 1.465 0.301 0 CA-C-O 120.571 0.224 . . . . 0.0 111.044 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -86.91 153.52 45.12 Favored 'Cis proline' 0 C--N 1.349 0.59 0 C-N-CA 123.655 -1.394 . . . . 0.0 113.449 0.473 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.599 HD23 ' HA ' ' A' ' 81' ' ' SER . 32.6 mt -138.38 157.1 46.89 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.923 179.712 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -114.43 118.44 33.83 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.002 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.435 HD11 ' HG3' ' A' ' 29' ' ' GLU . 37.5 mt -79.84 100.1 7.84 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.892 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.4 m170 -103.73 112.26 25.13 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.874 0.369 . . . . 0.0 111.247 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -94.96 115.89 28.02 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.23 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.3 ttm -101.84 124.95 48.34 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.986 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -79.56 -41.1 27.95 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.712 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -171.81 -64.17 0.02 OUTLIER 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.334 179.675 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.81 -29.49 7.95 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.576 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -107.2 155.3 20.05 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.852 0.358 . . . . 0.0 111.291 -179.42 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.6 t -114.81 132.95 56.31 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.983 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 28.9 mt -125.39 134.34 67.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.694 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.5 tt -83.14 132.71 35.07 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.652 0.263 . . . . 0.0 111.093 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.1 mt -87.27 110.67 20.36 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.64 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.07 -64.06 1.18 Allowed 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.45 -179.545 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -136.13 -169.04 2.34 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.82 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -54.12 -30.77 50.1 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.533 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -54.14 -42.31 69.38 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.62 0.247 . . . . 0.0 111.119 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.42 -48.46 69.96 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.806 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.3 tt -64.23 -39.63 94.37 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.201 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.643 ' HA ' HD12 ' A' ' 63' ' ' ILE . 10.4 m-20 -61.81 -43.28 99.16 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.746 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.19 -36.33 83.7 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.643 179.311 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.68 -38.95 92.38 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.327 179.571 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.643 HD12 ' HA ' ' A' ' 60' ' ' ASP . 13.6 mt -64.35 -44.4 97.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.8 0.333 . . . . 0.0 110.642 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -56.48 -42.82 78.9 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.053 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 27.2 mt -69.19 -38.33 77.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.805 179.648 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 9.6 tp -60.5 -46.0 91.72 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.865 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -60.61 -36.15 77.87 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.718 179.586 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.6 ttm-85 -63.15 -33.0 74.52 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.28 179.598 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 31.1 t -72.3 150.9 43.14 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 120.664 0.269 . . . . 0.0 111.219 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 4.4 m -81.03 -33.04 33.86 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.493 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.0 p -74.07 -69.22 0.46 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.67 -0.241 . . . . 0.0 111.532 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.7 ttt 54.14 81.41 0.1 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.872 0.368 . . . . 0.0 111.016 -179.768 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.6 ptpt -128.78 85.63 2.35 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.001 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.5 t 66.06 -179.83 0.2 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.384 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.7 mp -109.49 131.55 54.96 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.114 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.7 mtt85 -87.64 88.15 7.59 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.993 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 23.1 mt -122.39 127.31 75.06 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.132 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.931 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.634 HD12 ' HB2' ' A' ' 9' ' ' GLU . 0.6 OUTLIER -116.62 117.43 29.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.858 179.942 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.9 pp -96.2 127.97 42.69 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.804 0.335 . . . . 0.0 110.764 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.3 mp -112.79 147.51 36.76 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.353 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' SER . . . . . 0.599 ' HA ' HD23 ' A' ' 40' ' ' LEU . 1.3 p -95.1 147.47 23.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.824 179.695 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 . . . . . 0 C--O 1.235 0.294 0 CA-C-N 116.227 -0.442 . . . . 0.0 112.03 -179.979 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.467 0.406 0 CA-C-O 120.955 0.407 . . . . 0.0 111.145 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 15.4 t -106.3 128.98 60.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.336 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -86.88 115.85 24.56 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.676 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.454 HG21 ' CZ ' ' A' ' 8' ' ' PHE . 20.1 mm -104.74 125.69 59.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.134 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.8 ttmt -100.92 116.15 32.11 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.636 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.454 ' CZ ' HG21 ' A' ' 6' ' ' ILE . 54.5 m-85 -109.55 132.61 53.97 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.717 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -119.51 133.61 55.6 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.196 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -141.11 116.11 9.84 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.81 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 34.8 m-20 56.05 35.66 25.99 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.339 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.45 -27.93 12.44 Favored Glycine 0 CA--C 1.525 0.677 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.963 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.55 150.16 47.35 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.715 0.257 . . . . 0.0 111.145 179.794 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.6 mtm-85 -125.75 143.82 50.89 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.397 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.23 132.36 16.34 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.165 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.5 mt -109.3 122.97 64.79 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.742 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 26.4 mt -133.08 130.18 57.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.122 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -97.54 131.18 44.38 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.098 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -112.96 117.04 30.97 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.745 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.85 140.1 47.37 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.846 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.47 150.91 95.68 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.978 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.74 132.44 26.91 Favored 'Cis proline' 0 C--N 1.35 0.606 0 C-N-CA 123.298 -1.543 . . . . 0.0 112.731 0.114 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.6 p -89.64 124.43 42.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.718 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.543 ' O ' HG23 ' A' ' 28' ' ' VAL . 6.4 mttt -113.21 134.47 54.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.941 -179.497 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -56.54 -46.46 80.65 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.076 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.22 -44.91 88.43 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.025 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -65.12 -44.67 87.96 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.304 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.543 HG23 ' O ' ' A' ' 24' ' ' LYS . 45.4 t -67.71 -47.26 80.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.777 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -59.71 -44.29 93.78 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.653 179.472 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.445 ' HA ' HG22 ' A' ' 33' ' ' THR . 3.7 t60 -57.89 -38.91 76.66 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.239 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.737 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.6 OUTLIER -69.82 -49.96 47.58 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.799 -0.182 . . . . 0.0 111.099 179.924 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.8 t -67.49 -43.33 87.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.445 HG22 ' HA ' ' A' ' 30' ' ' HIS . 5.9 t -59.8 -39.1 83.84 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.526 -179.555 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.3 m -72.12 -39.9 68.52 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 111.474 0.176 . . . . 0.0 111.474 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.737 HG23 ' O ' ' A' ' 31' ' ' LYS . 60.8 t -60.66 -55.75 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 120.508 0.194 . . . . 0.0 111.314 -179.524 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.539 ' CE2' HD11 ' A' ' 79' ' ' LEU . 40.9 m-85 -84.6 -20.06 32.04 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -179.394 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.4 178.22 41.38 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.6 -179.579 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -126.38 160.2 59.08 Favored Pre-proline 0 CA--C 1.53 0.201 0 CA-C-O 120.586 0.232 . . . . 0.0 110.85 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -83.82 146.34 52.36 Favored 'Cis proline' 0 C--N 1.351 0.686 0 C-N-CA 123.521 -1.45 . . . . 0.0 113.221 0.14 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.705 HD23 ' HA ' ' A' ' 81' ' ' SER . 17.3 mt -137.52 146.58 44.35 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.918 179.582 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -116.35 134.51 54.81 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.165 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.33 114.51 27.06 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.876 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -114.3 111.58 21.72 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.073 -179.516 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 16.8 t80 -93.4 121.9 35.26 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.276 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.1 ptt? -123.98 132.2 53.67 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.843 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -97.51 -47.89 5.49 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.358 179.546 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -163.72 -71.32 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.26 179.204 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -109.85 -25.72 10.17 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.453 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -103.6 140.74 37.14 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.76 0.314 . . . . 0.0 111.256 -179.607 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.3 m -112.37 132.25 55.11 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.698 179.357 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 30.0 mm -114.54 133.87 59.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.774 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.21 120.71 32.36 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.853 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.577 HD23 ' HB3' ' A' ' 58' ' ' ASP . 40.5 mt -104.61 125.27 50.58 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.57 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.2 ttmp? -128.5 -55.73 1.24 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.971 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.4 m-20 -104.53 174.58 5.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.792 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -58.98 -33.9 71.2 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.944 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.95 -48.53 67.28 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 120.579 0.228 . . . . 0.0 111.279 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.577 ' HB3' HD23 ' A' ' 53' ' ' LEU . 14.6 m-20 -63.26 -47.19 83.4 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.564 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 20.5 tp -63.43 -40.23 96.61 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.44 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -61.48 -43.3 99.1 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.607 -0.27 . . . . 0.0 110.813 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -34.72 78.76 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.814 179.291 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.99 -35.23 79.52 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.138 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 31.3 mm -59.64 -46.52 93.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.473 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -53.16 -43.51 67.09 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.849 179.365 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 32.3 mt -65.24 -43.15 95.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.311 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.461 HD21 ' O ' ' A' ' 74' ' ' SER . 0.1 OUTLIER -69.24 -48.09 62.85 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.886 0.374 . . . . 0.0 110.728 179.683 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.03 -40.33 76.52 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.6 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 37.3 ptt85 -69.02 -29.7 67.93 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 111.58 0.215 . . . . 0.0 111.58 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 64.7 p -76.12 116.75 17.13 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 120.732 0.301 . . . . 0.0 110.828 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 50.5 p -74.4 -48.97 24.49 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.246 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.17 -48.06 77.45 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.283 -179.622 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.06 145.64 49.77 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.016 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.9 mttp -136.66 -51.93 0.69 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.074 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.461 ' O ' HD21 ' A' ' 66' ' ' LEU . 0.7 OUTLIER -81.1 166.1 21.01 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.886 179.927 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -101.05 126.67 47.75 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.182 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.0 mtt180 -93.33 81.99 4.46 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.05 0.453 . . . . 0.0 110.851 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.3 mt -107.27 114.16 45.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.558 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.81 117.05 34.04 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.54 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.539 HD11 ' CE2' ' A' ' 36' ' ' PHE . 0.2 OUTLIER -104.72 135.89 45.26 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.881 179.91 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -139.97 154.7 47.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.83 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' SER . . . . . 0.705 ' HA ' HD23 ' A' ' 40' ' ' LEU . 60.5 m -70.73 142.96 51.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.079 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.198 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 . . . . . 0 N--CA 1.489 1.493 0 CA-C-O 120.716 0.293 . . . . 0.0 111.045 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.0 m -126.48 156.82 40.11 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.071 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.4 t0 70.25 109.16 0.06 Allowed 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.055 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.9 t -94.91 116.37 36.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.269 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -87.25 115.42 24.63 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.735 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.512 HG12 HD13 ' A' ' 75' ' ' LEU . 22.7 mt -114.25 126.47 71.77 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.933 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.9 mtpt -100.65 115.45 30.24 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.873 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -101.58 138.93 37.93 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.025 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -122.44 128.17 50.55 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.962 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 25.2 t-80 -142.86 112.02 6.6 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.57 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 59.21 34.06 22.95 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.114 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.73 -31.01 6.82 Favored Glycine 0 CA--C 1.524 0.602 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.815 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -65.41 142.99 58.0 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.873 0.368 . . . . 0.0 111.151 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -119.71 143.55 47.71 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.362 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.92 134.89 30.65 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.948 179.617 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 22.1 mt -105.77 118.17 52.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.88 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.8 mt -128.33 129.9 69.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.179 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.46 147.44 23.54 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.2 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.402 ' CD2' HD12 ' A' ' 6' ' ' ILE . 13.0 m-85 -130.38 138.8 50.56 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.287 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.5 p -94.98 119.83 34.16 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.948 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.5 mtt180 -68.61 150.32 97.7 Favored Pre-proline 0 N--CA 1.464 0.254 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.893 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -72.72 144.43 80.77 Favored 'Cis proline' 0 C--N 1.35 0.623 0 C-N-CA 123.776 -1.343 . . . . 0.0 112.425 0.114 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.3 p -113.2 123.61 69.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.027 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.608 ' O ' HG23 ' A' ' 28' ' ' VAL . 3.7 mptt -101.01 137.52 39.27 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.048 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.713 ' HB2' HD22 ' A' ' 59' ' ' LEU . 66.0 t80 -54.78 -40.36 69.35 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.036 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -63.19 -45.31 92.34 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.973 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -64.37 -44.41 91.47 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.131 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.608 HG23 ' O ' ' A' ' 24' ' ' LYS . 26.3 t -62.46 -46.8 95.53 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.663 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.05 -46.07 85.97 Favored 'General case' 0 CA--C 1.528 0.111 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.038 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.05 -42.07 79.87 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 120.6 0.238 . . . . 0.0 111.246 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.787 ' O ' HG23 ' A' ' 35' ' ' VAL . 38.9 tttp -71.1 -49.8 40.47 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.25 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 28' ' ' VAL . 39.6 t -64.82 -41.53 92.42 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.765 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 54.9 m -58.81 -39.43 81.14 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.905 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.4 m -71.91 -36.81 70.09 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 121.369 -0.132 . . . . 0.0 111.258 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.787 HG23 ' O ' ' A' ' 31' ' ' LYS . 42.3 t -61.21 -55.18 26.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 N-CA-C 111.541 0.2 . . . . 0.0 111.541 -179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.641 ' CE2' HD21 ' A' ' 79' ' ' LEU . 71.4 m-85 -89.96 -19.68 24.21 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -178.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.431 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 105.07 179.24 24.24 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.301 -179.464 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -139.92 154.17 70.35 Favored Pre-proline 0 N--CA 1.464 0.271 0 O-C-N 122.819 -0.224 . . . . 0.0 110.914 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -85.84 148.73 44.04 Favored 'Cis proline' 0 C--N 1.351 0.684 0 C-N-CA 123.607 -1.414 . . . . 0.0 113.207 0.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.658 HD23 ' HA ' ' A' ' 81' ' ' SER . 20.0 mt -138.74 158.59 43.95 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.03 179.758 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -113.3 140.35 48.07 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.002 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.473 ' O ' HD13 ' A' ' 52' ' ' LEU . 12.9 mt -102.75 107.08 17.84 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.196 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -104.03 125.65 50.55 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.128 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -114.53 130.3 56.74 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.408 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 9.4 ptp -128.62 122.16 30.28 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.853 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -79.91 -59.7 2.63 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.462 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -175.03 -55.75 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.463 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -106.8 -26.32 11.32 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.551 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.3 mt -123.36 145.68 48.55 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.715 0.293 . . . . 0.0 111.248 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 56.1 p -120.82 132.78 55.2 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.811 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mp -126.94 132.53 69.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.972 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.473 HD13 ' O ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -85.33 118.98 25.2 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.323 179.783 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 26.8 mt -65.89 105.73 1.38 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.945 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.0 mttp -110.88 -35.82 5.85 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.222 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -136.47 171.91 13.79 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.105 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -58.2 -29.94 66.07 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.119 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.438 ' HA ' ' OD2' ' A' ' 60' ' ' ASP . 1.2 m-20 -56.26 -43.5 78.79 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.116 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -66.89 -32.22 73.34 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.799 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.713 HD22 ' HB2' ' A' ' 25' ' ' TYR . 33.1 tp -64.86 -45.44 86.08 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.726 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.438 ' OD2' ' HA ' ' A' ' 57' ' ' ASP . 2.5 p30 -70.56 -31.85 69.03 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.577 0.227 . . . . 0.0 110.975 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -38.02 89.06 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.713 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.43 -42.98 86.92 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.2 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.3 mm -66.34 -41.69 89.36 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.156 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -55.15 -45.46 75.67 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.192 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.6 mt -66.57 -39.27 83.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.813 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 20.0 tp -64.56 -43.67 93.2 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.877 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -57.16 -42.68 81.55 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.069 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.71 -31.95 72.96 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.073 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 27.5 t -79.03 146.18 33.46 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.128 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.63 -18.75 62.18 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.541 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 60.3 p -93.57 38.2 1.06 Allowed 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.756 0.312 . . . . 0.0 111.554 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.35 84.71 4.51 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.639 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp -138.93 -58.99 0.6 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.929 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.1 p -112.99 168.22 9.87 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.041 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.512 HD13 HG12 ' A' ' 6' ' ' ILE . 5.5 mp -122.62 138.81 54.48 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.038 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 7.4 ttp180 -97.31 87.57 4.19 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.982 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.1 mt -117.68 118.2 57.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.691 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.3 tt -108.52 128.65 54.99 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.178 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.641 HD21 ' CE2' ' A' ' 36' ' ' PHE . 3.5 pp -113.76 136.61 52.67 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.846 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -135.6 148.19 48.95 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.163 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.658 ' HA ' HD23 ' A' ' 40' ' ' LEU . 2.6 p -72.65 147.39 45.81 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.391 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -78.81 3.41 16.84 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -179.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.3 t70 62.96 127.38 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.098 0.559 . . . . 0.0 112.059 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.5 mtt85 72.28 125.81 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.004 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.3 p-10 -105.97 155.8 19.01 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.557 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.3 mp -107.29 100.52 9.96 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.18 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -160.23 63.32 0.34 Allowed 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.043 0.449 . . . . 0.0 111.205 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.88 165.3 17.89 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.457 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -120.42 -69.47 0.84 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.566 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 16.7 p80 -159.6 156.84 28.68 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.962 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -161.16 155.32 22.73 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.901 0.381 . . . . 0.0 111.385 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.17 146.56 49.04 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.902 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.081 -0.962 . . . . 0.0 111.346 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 120.586 0.232 . . . . 0.0 111.194 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.433 ' O ' ' HA ' ' A' ' 20' ' ' SER . 1.4 m 58.3 81.49 0.15 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.174 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -171.96 94.42 0.15 Allowed 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.987 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 22.2 t -96.08 123.19 48.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.888 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.7 mtt180 -87.29 114.81 24.23 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.951 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.491 HG21 HD12 ' A' ' 77' ' ' ILE . 23.7 mt -105.9 118.51 53.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.827 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -103.65 114.7 29.16 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.363 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.513 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 0.9 OUTLIER -117.6 145.53 44.25 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.921 -179.774 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -119.21 139.88 51.12 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.615 -179.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.52 ' HB2' HD11 ' A' ' 79' ' ' LEU . 24.5 t-80 -141.02 114.65 8.89 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.364 179.592 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 51.3 m-20 57.63 33.47 23.29 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.657 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.14 -47.0 1.14 Allowed Glycine 0 C--N 1.336 0.545 0 C-N-CA 120.863 -0.684 . . . . 0.0 113.36 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.24 145.39 51.39 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.815 0.34 . . . . 0.0 110.997 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 ptp180 -124.1 147.66 47.74 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.622 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.513 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -131.02 137.33 49.14 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.749 179.641 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 19.1 mt -117.41 126.32 74.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.908 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 28.0 mt -138.98 131.6 37.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.957 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.37 145.73 24.72 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.179 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -131.13 125.36 32.89 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.116 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.433 ' HA ' ' O ' ' A' ' 2' ' ' SER . 40.7 t -71.39 126.68 30.29 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.007 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 25.6 mtt85 -71.6 144.91 89.3 Favored Pre-proline 0 CA--C 1.53 0.192 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.031 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -77.38 123.12 9.2 Favored 'Cis proline' 0 C--N 1.349 0.581 0 C-N-CA 123.193 -1.586 . . . . 0.0 112.612 -0.084 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.3 p -72.27 145.4 12.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.058 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.576 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.5 mmmt -111.38 132.28 54.55 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.259 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.401 ' HD1' HD13 ' A' ' 59' ' ' LEU . 64.4 t80 -57.46 -43.29 83.88 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.895 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -59.19 -43.56 92.21 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.167 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.402 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -65.7 -44.57 85.74 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.346 -179.955 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.576 HG23 ' O ' ' A' ' 24' ' ' LYS . 23.7 t -65.39 -47.97 84.9 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.738 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.51 ' HG2' HD11 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -63.67 -46.14 86.92 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.345 179.912 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 67.2 t60 -56.38 -41.01 75.51 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.535 0.207 . . . . 0.0 111.443 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.78 ' O ' HG23 ' A' ' 35' ' ' VAL . 8.4 tttp -71.05 -49.79 40.97 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.341 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 28' ' ' VAL . 46.5 t -66.4 -43.01 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.602 -179.555 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 53.4 m -59.05 -39.24 81.42 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.314 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.5 m -72.2 -36.69 69.26 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.399 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.78 HG23 ' O ' ' A' ' 31' ' ' LYS . 57.0 t -62.34 -51.6 70.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.544 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -95.59 -18.09 20.85 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -178.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.679 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 105.93 -177.51 22.58 Favored Glycine 0 CA--C 1.523 0.557 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.599 -179.391 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.411 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 7.6 pm0 -134.08 155.43 80.07 Favored Pre-proline 0 N--CA 1.463 0.219 0 O-C-N 122.776 -0.249 . . . . 0.0 111.098 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.411 ' HA ' ' HB2' ' A' ' 38' ' ' GLN . 83.4 Cg_endo -90.0 145.1 17.82 Favored 'Cis proline' 0 C--N 1.348 0.508 0 C-N-CA 123.651 -1.396 . . . . 0.0 113.101 0.233 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.679 HD12 ' O ' ' A' ' 37' ' ' GLY . 23.2 mt -138.49 139.87 38.96 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.831 179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -112.4 140.28 47.27 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.092 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.51 HD11 ' HG2' ' A' ' 29' ' ' GLU . 3.7 mt -87.45 113.97 23.63 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.036 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -106.04 117.54 34.28 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.014 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.403 ' HB3' HD23 ' A' ' 53' ' ' LEU . 14.2 t80 -107.17 122.84 47.31 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 120.783 0.325 . . . . 0.0 110.697 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 28.2 mtp -110.62 128.17 55.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.431 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -71.3 -56.42 6.05 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.711 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -178.86 -52.99 0.01 OUTLIER 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.329 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -104.73 -29.73 10.38 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.53 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -119.68 160.35 22.69 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.876 0.37 . . . . 0.0 111.522 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.5 m -104.64 132.33 51.02 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.988 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 25.1 mm -116.02 133.45 62.44 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.916 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.0 mt -104.4 125.15 50.35 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.89 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.403 HD23 ' HB3' ' A' ' 44' ' ' TYR . 0.9 OUTLIER -119.59 106.13 11.88 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.398 179.924 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -107.77 -34.43 6.97 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.137 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -98.23 166.11 11.56 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.626 0.25 . . . . 0.0 110.825 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.06 -35.64 80.93 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.04 179.428 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -52.84 -47.05 68.02 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.141 179.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.4 -31.66 72.56 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.177 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.401 HD13 ' HD1' ' A' ' 25' ' ' TYR . 6.0 tp -72.69 -39.03 67.34 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.68 -0.236 . . . . 0.0 110.552 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.86 -43.5 98.71 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.268 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -66.63 -38.84 87.77 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.818 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.31 -45.0 93.38 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.562 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 14.1 mt -66.37 -41.13 88.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.894 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -55.08 -44.96 75.33 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.039 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.3 mt -64.82 -43.11 96.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.733 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.753 HD12 ' HB3' ' A' ' 72' ' ' MET . 9.2 tp -62.01 -47.3 85.39 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.129 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.97 -37.49 87.84 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.246 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -72.61 -35.27 67.82 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.069 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.0 t -76.39 128.26 34.47 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.39 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 27.9 p -75.09 -38.43 61.22 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.826 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.74 -47.16 32.74 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.171 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.753 ' HB3' HD12 ' A' ' 66' ' ' LEU . 1.8 mpp? -78.79 91.76 4.76 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.113 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.9 mtpt -97.0 -45.81 6.44 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.184 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.465 ' O ' HD11 ' A' ' 66' ' ' LEU . 2.8 p -91.0 151.2 21.15 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.902 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.699 ' HG ' HD22 ' A' ' 66' ' ' LEU . 0.2 OUTLIER -91.98 124.15 35.87 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.01 -179.955 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -93.68 88.9 6.0 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.878 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.491 HD12 HG21 ' A' ' 6' ' ' ILE . 31.1 mt -111.93 117.66 55.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.583 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.589 HD23 HD11 ' A' ' 80' ' ' LEU . 4.9 tp -102.06 123.69 46.37 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.852 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.52 HD11 ' HB2' ' A' ' 10' ' ' HIS . 2.3 pp -112.07 130.99 55.7 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.778 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.589 HD11 HD23 ' A' ' 78' ' ' LEU . 0.4 OUTLIER -131.5 142.69 50.01 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.988 -179.439 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.51 143.79 27.55 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.859 179.299 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -89.59 5.05 47.36 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.971 -0.558 . . . . 0.0 112.1 179.604 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 61.33 173.72 0.11 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.82 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -119.12 91.18 3.49 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.173 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -90.66 -174.73 4.18 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.038 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.78 62.31 7.38 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 120.854 0.359 . . . . 0.0 111.42 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -151.86 25.68 0.65 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.409 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 12.5 m80 -115.67 -23.98 8.46 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.58 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 65.55 74.62 0.37 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.786 0.327 . . . . 0.0 111.099 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -137.56 -72.58 0.42 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.511 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -177.19 177.35 1.24 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.841 0.353 . . . . 0.0 110.907 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -148.84 -55.69 0.2 Allowed 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.74 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 14.3 p80 . . . . . 0 C--O 1.251 1.149 0 CA-C-O 118.355 -0.831 . . . . 0.0 111.216 179.833 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 120.811 0.339 . . . . 0.0 111.125 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.3 m -151.72 99.57 2.6 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.153 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -170.1 89.83 0.17 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.162 0.506 . . . . 0.0 111.359 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 23.1 t -90.42 116.38 31.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.926 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.6 mtt180 -90.06 121.79 32.46 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.744 0.307 . . . . 0.0 111.049 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.534 HG23 ' HB2' ' A' ' 75' ' ' LEU . 2.6 mt -115.57 130.06 70.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.989 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.4 tttm -95.45 126.89 41.06 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.699 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -117.1 136.25 53.14 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.282 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.728 ' HB3' HD12 ' A' ' 78' ' ' LEU . 1.6 mt-10 -121.96 127.54 50.47 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.074 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.6 t-80 -131.13 112.57 12.98 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.686 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 55.67 34.76 23.92 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.523 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 98.69 -35.42 4.64 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.686 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.79 136.58 57.07 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.716 0.293 . . . . 0.0 110.817 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.13 145.29 41.19 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.621 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.63 130.2 13.97 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.087 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.9 mp -102.49 125.8 56.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.808 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.6 mt -130.38 134.29 62.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.219 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.27 138.8 31.22 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.248 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.492 ' CD1' HD12 ' A' ' 6' ' ' ILE . 38.5 m-85 -130.78 117.4 19.32 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.76 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.1 m -76.85 143.34 39.77 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.728 0.299 . . . . 0.0 111.188 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.5 mtm105 -96.05 154.98 38.75 Favored Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.125 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -73.12 142.44 74.76 Favored 'Cis proline' 0 C--N 1.349 0.597 0 C-N-CA 123.57 -1.429 . . . . 0.0 112.335 -0.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.5 p -128.41 147.58 32.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.944 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.483 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -115.97 143.96 44.73 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.007 -179.875 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.554 ' OH ' HD12 ' A' ' 42' ' ' LEU . 64.3 t80 -56.52 -36.95 69.8 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.285 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.87 -44.93 91.19 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.9 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.44 ' HB2' ' HG2' ' A' ' 24' ' ' LYS . 8.7 t0 -69.63 -44.3 70.9 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.007 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.689 ' O ' HG23 ' A' ' 32' ' ' VAL . 38.7 t -64.52 -46.16 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.866 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -58.65 -42.19 87.81 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.286 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -57.42 -46.1 83.88 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.742 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.714 ' O ' HG23 ' A' ' 35' ' ' VAL . 18.5 tttp -70.18 -48.78 55.77 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.943 179.673 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.689 HG23 ' O ' ' A' ' 28' ' ' VAL . 44.4 t -58.81 -42.37 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-N 116.76 -0.2 . . . . 0.0 111.318 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 86.4 m -64.19 -39.58 94.3 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.056 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 60.1 m -72.47 -42.72 64.63 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.449 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.714 HG23 ' O ' ' A' ' 31' ' ' LYS . 57.5 t -61.98 -51.37 73.34 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.405 ' CE2' HD21 ' A' ' 79' ' ' LEU . 41.7 m-85 -87.81 -20.95 25.39 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -179.204 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.405 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 103.49 -175.72 23.76 Favored Glycine 0 C--N 1.337 0.631 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.676 -179.615 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -144.32 155.46 57.73 Favored Pre-proline 0 N--CA 1.465 0.316 0 CA-C-O 120.528 0.204 . . . . 0.0 111.01 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -84.09 137.63 28.16 Favored 'Cis proline' 0 C--N 1.35 0.641 0 C-N-CA 123.546 -1.439 . . . . 0.0 113.205 0.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.687 HD23 ' HA ' ' A' ' 81' ' ' SER . 97.8 mt -137.18 130.41 31.02 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.744 179.488 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -105.09 139.86 39.13 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.729 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.622 HD23 ' HB3' ' A' ' 79' ' ' LEU . 64.7 mt -92.16 108.53 20.01 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.808 0.337 . . . . 0.0 110.94 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -109.36 117.74 34.83 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.495 -179.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.745 ' HB2' HD11 ' A' ' 53' ' ' LEU . 12.4 t80 -96.1 124.52 40.14 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.392 179.569 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 53.4 mtp -117.56 125.87 51.57 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.542 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.1 t30 -87.48 -52.61 5.26 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.777 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -173.58 -62.55 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.369 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -108.82 -25.55 10.73 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.565 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -111.93 149.33 32.07 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.823 0.344 . . . . 0.0 111.147 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.6 m -113.22 131.15 56.01 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.978 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.8 mt -121.63 133.99 66.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.909 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.9 mp -105.34 124.65 49.9 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.709 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.745 HD11 ' HB2' ' A' ' 44' ' ' TYR . 1.2 mp -91.81 92.61 8.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.721 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 42.8 mttm -111.17 30.44 6.9 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.134 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -175.97 167.39 3.02 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.912 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -63.13 -38.95 93.22 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.311 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.36 -44.45 80.14 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.338 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -64.78 -46.16 83.27 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.001 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 33.0 tp -61.26 -41.25 96.58 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.664 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -61.17 -43.09 99.43 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.575 179.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.3 mttm -65.31 -38.67 90.92 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.011 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.54 -41.35 98.82 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.015 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 18.8 mt -64.9 -43.84 96.25 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.081 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.662 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.67 -45.06 73.83 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.206 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 41.5 mt -68.36 -45.24 82.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.353 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.628 ' C ' HD13 ' A' ' 66' ' ' LEU . 1.5 tm? -65.92 -48.05 72.7 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.041 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.401 ' N ' HD13 ' A' ' 66' ' ' LEU . 1.9 t70 -60.2 -41.77 93.67 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.296 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -74.15 -31.65 62.81 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.66 -179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 76.9 p -80.91 112.07 17.96 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.6 0.238 . . . . 0.0 110.663 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 53.0 m -71.43 -30.32 65.91 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.062 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.16 -34.09 71.68 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.587 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 5.9 ttm -111.61 140.97 45.79 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.649 0.261 . . . . 0.0 111.053 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.4 mttt -115.46 -44.36 2.98 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.118 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 67.5 m -100.46 170.98 8.03 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.745 179.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.534 ' HB2' HG23 ' A' ' 6' ' ' ILE . 0.7 OUTLIER -91.87 120.6 32.71 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.786 179.941 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.0 mmt85 -91.76 73.98 5.78 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.537 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 36.0 mt -111.34 124.71 68.37 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.833 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.728 HD12 ' HB3' ' A' ' 9' ' ' GLU . 4.9 tp -102.08 119.63 39.11 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.863 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.622 ' HB3' HD23 ' A' ' 42' ' ' LEU . 2.0 pp -106.86 125.07 50.53 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.888 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.435 ' O ' HD12 ' A' ' 80' ' ' LEU . 1.0 OUTLIER -116.8 162.75 17.21 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.282 179.941 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.687 ' HA ' HD23 ' A' ' 40' ' ' LEU . 40.6 t -88.21 137.4 32.36 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.993 179.809 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 10.8 tp60 -87.39 5.7 37.41 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.687 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -85.03 179.58 7.25 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.912 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -116.29 34.39 5.04 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.265 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -97.78 87.23 3.97 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.947 0.404 . . . . 0.0 111.057 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.9 tt -153.57 90.25 1.39 Allowed 'General case' 0 C--O 1.235 0.337 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.037 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -142.99 91.78 2.33 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.861 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.4 m-70 -126.8 -49.53 1.49 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.237 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 17.6 p-80 -172.31 -37.98 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.351 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -51.99 100.67 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 120.807 0.337 . . . . 0.0 111.008 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -155.37 -59.02 0.1 Allowed 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.773 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 62.93 -175.24 0.15 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.499 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 . . . . . 0 C--O 1.251 1.155 0 CA-C-O 118.535 -0.745 . . . . 0.0 111.366 179.974 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.507 0 CA-C-O 120.669 0.271 . . . . 0.0 111.211 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.5 p -124.6 145.02 49.84 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.12 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 69.86 114.04 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.205 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.8 t -86.06 110.48 19.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.982 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.26 108.8 19.11 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.688 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 19.5 mt -109.54 128.45 65.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.837 0.351 . . . . 0.0 111.44 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -101.35 123.4 45.38 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.828 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.619 ' CZ ' HG21 ' A' ' 32' ' ' VAL . 84.7 m-85 -115.03 139.88 49.51 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.041 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -124.26 125.44 44.39 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.959 0.409 . . . . 0.0 111.102 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -138.25 124.02 19.89 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.513 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 57.64 32.07 21.31 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.29 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.36 -41.38 2.59 Favored Glycine 0 C--N 1.337 0.607 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.816 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -68.87 152.25 45.54 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 120.778 0.323 . . . . 0.0 111.332 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.15 151.43 35.67 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.186 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.3 mtt85 -128.5 127.51 42.56 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.736 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.511 ' O ' HD13 ' A' ' 17' ' ' ILE . 2.8 mt -98.18 117.02 42.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.747 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.511 HD13 ' O ' ' A' ' 16' ' ' ILE . 25.5 mm -131.2 133.42 62.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-O 120.826 0.346 . . . . 0.0 111.068 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -107.41 136.88 46.47 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.047 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.437 ' CZ ' ' HA ' ' A' ' 28' ' ' VAL . 8.5 m-85 -121.24 126.93 50.81 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.5 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -82.33 150.13 27.37 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.98 179.356 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.8 mtt-85 -87.63 143.11 33.35 Favored Pre-proline 0 N--CA 1.463 0.192 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.87 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -78.92 166.54 79.06 Favored 'Cis proline' 0 C--N 1.352 0.753 0 C-N-CA 123.661 -1.391 . . . . 0.0 112.766 0.13 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.5 p -146.85 139.49 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.099 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -114.65 159.79 20.07 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.681 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.475 ' CD1' HD13 ' A' ' 59' ' ' LEU . 37.6 t80 -55.53 -40.62 72.06 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.666 -0.243 . . . . 0.0 110.958 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.12 -43.43 91.94 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.009 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -63.02 -44.64 95.37 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.987 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.609 ' O ' HG23 ' A' ' 32' ' ' VAL . 41.1 t -68.0 -47.7 77.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.907 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -64.01 -44.91 91.16 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.172 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -56.4 -43.45 79.33 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.421 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.798 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.5 OUTLIER -69.35 -49.33 56.62 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.096 179.878 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.619 HG21 ' CZ ' ' A' ' 8' ' ' PHE . 47.6 t -63.13 -44.84 99.64 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.511 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 90.4 m -58.42 -39.37 79.58 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.982 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 28.5 m -72.27 -40.8 67.37 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 121.186 -0.206 . . . . 0.0 111.303 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.798 HG23 ' O ' ' A' ' 31' ' ' LYS . 58.9 t -56.83 -51.85 62.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 120.558 0.218 . . . . 0.0 111.553 -179.396 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.666 ' CE2' HD21 ' A' ' 79' ' ' LEU . 81.6 m-85 -90.37 -27.4 19.38 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.115 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.736 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 102.44 -160.12 17.5 Favored Glycine 0 C--N 1.336 0.536 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.577 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -144.88 158.46 52.71 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 120.446 0.165 . . . . 0.0 110.868 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -87.5 131.77 12.07 Favored 'Cis proline' 0 C--N 1.346 0.427 0 C-N-CA 123.649 -1.396 . . . . 0.0 113.055 0.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.736 HD12 ' O ' ' A' ' 37' ' ' GLY . 17.9 mt -136.71 147.71 46.92 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.089 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -114.55 130.17 56.73 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.991 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.438 HD21 HG11 ' A' ' 32' ' ' VAL . 3.5 mt -87.8 110.07 20.21 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.873 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -115.41 119.46 36.32 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.495 -179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.796 ' HB3' HD21 ' A' ' 53' ' ' LEU . 12.7 t80 -98.59 130.44 45.13 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.867 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -101.95 131.02 48.59 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.642 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -77.99 -40.12 40.17 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.786 0.327 . . . . 0.0 110.797 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -174.48 -54.51 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.202 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.8 -41.08 3.85 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.353 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -100.36 165.94 11.21 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.995 0.426 . . . . 0.0 111.388 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.5 m -121.29 122.25 39.49 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.763 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.15 131.78 65.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.184 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.11 135.07 34.55 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.709 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.796 HD21 ' HB3' ' A' ' 44' ' ' TYR . 0.5 OUTLIER -98.42 86.64 3.66 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.456 179.85 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -99.55 24.57 8.04 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.672 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -166.08 160.05 16.01 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.588 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.8 -40.82 89.64 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.73 0.3 . . . . 0.0 110.394 179.428 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -61.94 -46.25 90.11 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.984 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -60.67 -44.33 96.6 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.882 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.475 HD13 ' CD1' ' A' ' 25' ' ' TYR . 4.7 tp -63.01 -42.96 99.97 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.111 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -69.45 -34.84 74.99 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.277 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.0 ttpt -62.39 -37.01 84.09 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.863 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.77 -37.86 89.05 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.991 179.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 33.2 mm -63.75 -43.92 98.14 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.19 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -53.9 -36.48 62.76 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.053 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.8 mt -66.63 -40.11 85.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.819 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 26.2 tp -62.39 -40.06 95.26 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.118 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.19 -34.36 68.43 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.3 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.0 -34.51 76.64 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.898 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.4 t -81.61 97.93 8.1 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.048 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.3 p -63.69 -33.76 76.36 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.404 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.8 p -71.16 -49.31 45.25 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.246 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.9 ttm -67.89 147.21 52.81 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.075 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.28 -48.34 0.59 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.31 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.41 171.11 15.57 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.706 0.289 . . . . 0.0 110.842 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.449 ' HB3' HD11 ' A' ' 77' ' ' ILE . 4.0 mm? -102.36 118.25 36.48 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.744 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -92.16 84.04 5.19 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.777 0.322 . . . . 0.0 110.93 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.449 HD11 ' HB3' ' A' ' 75' ' ' LEU . 2.9 mt -109.29 128.56 65.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.004 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.518 HD12 HD11 ' A' ' 80' ' ' LEU . 0.5 OUTLIER -113.36 123.8 50.96 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.32 -179.844 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.666 HD21 ' CE2' ' A' ' 36' ' ' PHE . 2.8 pp -112.97 131.48 55.74 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.696 179.484 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.518 HD11 HD12 ' A' ' 78' ' ' LEU . 1.7 mp -121.09 151.22 40.1 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.241 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.473 ' HA ' HD23 ' A' ' 40' ' ' LEU . 2.5 t -98.14 147.41 24.6 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.119 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.93 5.82 44.71 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.651 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -89.04 89.4 7.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.962 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 18.2 mtp180 66.11 104.41 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.355 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 32.2 t30 -129.19 155.85 44.86 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.217 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.1 tp -112.97 166.12 11.7 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.915 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -66.81 -67.94 0.41 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.861 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -175.53 114.64 0.14 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.915 0.388 . . . . 0.0 111.094 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -148.16 155.8 41.84 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.164 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 60.3 30.88 20.2 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.061 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 6.8 t-160 -142.82 77.54 1.58 Allowed 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.49 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 33.8 m80 -126.69 136.96 53.16 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.04 -179.391 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 16.1 t-80 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.435 -0.793 . . . . 0.0 111.088 -179.881 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 120.902 0.382 . . . . 0.0 111.366 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.38 79.24 5.62 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.122 0.487 . . . . 0.0 110.927 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.504 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 14.4 p-10 -95.61 100.95 12.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.205 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 32.2 t -75.77 129.63 36.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.973 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -87.81 112.06 22.05 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.78 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.418 ' HA ' ' HB2' ' A' ' 75' ' ' LEU . 19.8 mt -99.11 125.9 52.49 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.02 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.0 mttt -99.33 117.67 34.28 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.8 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.449 ' CD1' HD12 ' A' ' 17' ' ' ILE . 80.0 m-85 -107.37 145.72 32.52 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.036 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -125.9 126.1 43.87 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.13 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.0 t-160 -141.27 116.94 10.31 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.567 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 16.0 m120 57.21 34.92 25.52 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.236 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.94 -38.34 3.17 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.864 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -65.3 150.81 47.62 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.759 0.314 . . . . 0.0 111.291 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.58 157.14 37.88 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.357 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.2 142.28 24.92 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.056 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.3 mp -114.59 119.56 61.87 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.941 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.449 HD12 ' CD1' ' A' ' 8' ' ' PHE . 3.1 mt -127.12 130.79 71.16 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.038 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.504 ' HB1' ' HB2' ' A' ' 3' ' ' ASP . . . -94.11 143.42 26.38 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.434 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.403 ' CD2' HD12 ' A' ' 6' ' ' ILE . 44.8 m-85 -137.6 117.08 12.86 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.903 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.9 p -72.69 143.21 48.16 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.083 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.82 153.92 37.65 Favored Pre-proline 0 C--O 1.232 0.171 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.305 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -74.53 140.57 68.02 Favored 'Cis proline' 0 C--N 1.351 0.706 0 C-N-CA 123.54 -1.442 . . . . 0.0 112.528 0.03 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.9 p -127.01 143.67 39.71 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.048 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.64 142.48 27.3 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.062 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 50.3 t80 -59.58 -36.99 77.31 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.209 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.56 -45.0 89.89 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.995 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -63.05 -44.58 95.48 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.157 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.693 ' O ' HG23 ' A' ' 32' ' ' VAL . 24.9 t -67.05 -46.7 84.0 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.935 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.444 ' HG2' HD11 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -58.64 -45.2 89.81 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.169 179.916 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -56.78 -46.77 81.29 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.761 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.755 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.3 OUTLIER -67.06 -49.83 63.81 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.3 179.784 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.693 HG23 ' O ' ' A' ' 28' ' ' VAL . 47.4 t -58.48 -43.29 86.52 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.335 -179.716 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 95.4 m -62.8 -39.45 94.3 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.02 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 39.0 m -72.08 -42.86 65.68 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 121.254 -0.178 . . . . 0.0 111.425 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.755 HG23 ' O ' ' A' ' 31' ' ' LYS . 59.7 t -56.57 -51.91 59.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-O 120.54 0.21 . . . . 0.0 111.533 -179.449 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.537 ' CE2' HD21 ' A' ' 79' ' ' LEU . 76.7 m-85 -88.32 -28.21 21.18 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.303 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.66 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 101.73 -159.95 18.17 Favored Glycine 0 C--N 1.334 0.442 0 C-N-CA 121.0 -0.619 . . . . 0.0 112.347 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.76 156.15 55.98 Favored Pre-proline 0 N--CA 1.464 0.244 0 CA-C-O 120.437 0.16 . . . . 0.0 110.787 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -88.07 131.35 10.97 Favored 'Cis proline' 0 C--N 1.35 0.639 0 C-N-CA 123.559 -1.434 . . . . 0.0 112.939 0.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.66 HD12 ' O ' ' A' ' 37' ' ' GLY . 6.4 mt -138.34 130.55 28.7 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.138 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -101.64 135.2 43.56 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.019 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.444 HD11 ' HG2' ' A' ' 29' ' ' GLU . 9.3 mt -91.27 104.16 16.74 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.781 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -106.48 129.71 54.4 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.27 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -106.1 119.32 38.91 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.582 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.414 ' O ' ' HD2' ' A' ' 76' ' ' ARG . 5.3 mtt -131.76 140.01 49.11 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.933 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 -99.35 -45.98 5.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.775 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -172.95 -64.11 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.486 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -108.82 -30.83 7.95 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.464 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.3 mt -93.73 132.58 37.95 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.716 0.293 . . . . 0.0 111.227 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 94.8 p -112.1 122.58 48.15 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.798 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.0 mp -127.5 132.72 69.01 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.032 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.526 HD23 ' N ' ' A' ' 53' ' ' LEU . 1.9 tt -102.96 131.17 50.11 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.515 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.526 ' N ' HD23 ' A' ' 52' ' ' LEU . 12.1 mt -74.52 84.75 2.03 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.085 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.2 tptt -77.86 -37.61 47.89 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.977 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -145.23 -179.24 6.51 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.139 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -57.47 -35.09 69.71 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.842 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.24 -46.18 79.69 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.963 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -60.45 -41.61 94.44 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.711 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.7 tp -63.42 -43.45 97.45 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.125 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.46 -41.11 98.52 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.254 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.04 -35.75 81.27 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.684 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.96 -38.34 90.71 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.166 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.6 mm -63.89 -42.43 95.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.083 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -56.71 -39.46 73.91 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.035 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 47.6 mt -68.36 -40.48 82.47 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.046 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.717 HD11 ' HG ' ' A' ' 75' ' ' LEU . 92.8 mt -61.05 -46.9 88.82 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.061 179.817 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.91 -31.34 70.86 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.176 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.7 mmt180 -66.94 -28.02 67.94 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.257 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.8 t -59.75 148.49 34.08 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.872 0.367 . . . . 0.0 111.502 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.07 -35.52 71.93 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.234 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -158.36 93.25 1.2 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.996 0.427 . . . . 0.0 111.754 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -167.22 107.83 0.61 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.053 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -99.28 -31.89 11.47 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.341 179.719 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.87 165.03 25.7 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.744 0.307 . . . . 0.0 111.372 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.717 ' HG ' HD11 ' A' ' 66' ' ' LEU . 0.5 OUTLIER -110.27 131.66 54.86 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.281 -179.915 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.414 ' HD2' ' O ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -87.18 78.95 8.74 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.936 179.86 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.618 HD11 HD23 ' A' ' 75' ' ' LEU . 32.7 mm -104.01 113.58 41.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.607 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.55 HD21 HD21 ' A' ' 80' ' ' LEU . 6.4 tt -110.77 117.15 32.66 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.861 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.537 HD21 ' CE2' ' A' ' 36' ' ' PHE . 2.5 pp -112.33 130.61 55.9 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.874 0.368 . . . . 0.0 110.967 179.567 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.55 HD21 HD21 ' A' ' 78' ' ' LEU . 0.4 OUTLIER -121.64 156.94 31.93 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.204 -179.747 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 6.1 t -83.01 147.65 28.04 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.779 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 33.2 tp60 -84.55 5.96 25.65 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.915 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -89.66 117.98 28.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.193 -179.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 67.73 100.16 0.05 Allowed 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.348 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -142.26 75.38 1.49 Allowed 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.021 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 55.91 73.53 0.43 Allowed 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.088 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -157.43 -50.27 0.07 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.357 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -82.88 141.5 32.18 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.044 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 23.3 m80 62.5 75.99 0.38 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.198 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 12.3 t-160 -138.73 101.1 4.24 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.947 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -126.15 120.31 29.79 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.437 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 21.9 p80 -105.36 133.52 49.98 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.266 -179.379 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.094 -0.955 . . . . 0.0 111.537 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 120.786 0.327 . . . . 0.0 111.091 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m -117.53 160.0 21.95 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.638 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 60.87 80.21 0.22 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.896 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 25.4 t -86.18 145.04 8.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.424 -179.614 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -93.49 106.41 18.38 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.017 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.2 mt -104.69 125.96 59.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.071 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -103.93 129.47 51.48 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.596 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -111.83 131.55 55.27 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.859 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.445 ' HG3' ' HG3' ' A' ' 14' ' ' ARG . 24.7 tt0 -119.39 130.01 55.09 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.819 0.342 . . . . 0.0 111.116 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.7 t-160 -141.07 121.0 13.59 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.694 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 61.07 26.2 16.16 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.604 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.36 -46.96 1.14 Allowed Glycine 0 C--N 1.338 0.644 0 C-N-CA 120.912 -0.661 . . . . 0.0 113.415 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -66.02 139.58 58.22 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.925 0.362 . . . . 0.0 111.275 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.445 ' HG3' ' HG3' ' A' ' 9' ' ' GLU . 2.6 mtt85 -108.91 155.25 21.05 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.419 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.1 149.22 50.0 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.926 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.45 ' O ' HD13 ' A' ' 17' ' ' ILE . 34.3 mt -115.32 117.68 56.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.078 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.45 HD13 ' O ' ' A' ' 16' ' ' ILE . 21.2 mm -131.57 136.49 57.17 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.257 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.53 141.32 28.74 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.992 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -128.91 117.1 20.43 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.937 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 37.8 t -86.29 140.84 29.71 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.89 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -84.79 157.53 60.46 Favored Pre-proline 0 CA--C 1.531 0.25 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.025 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.75 157.48 99.52 Favored 'Cis proline' 0 C--N 1.35 0.628 0 C-N-CA 123.486 -1.464 . . . . 0.0 112.77 0.063 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.7 p -139.25 139.25 39.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.196 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.577 ' O ' HG23 ' A' ' 28' ' ' VAL . 9.3 mptt -119.47 154.61 33.5 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.719 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.45 ' CD1' HD11 ' A' ' 59' ' ' LEU . 23.1 t80 -54.35 -45.13 72.65 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.85 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.43 -41.94 99.09 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.16 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -62.58 -44.24 96.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.987 -179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.654 ' O ' HG23 ' A' ' 32' ' ' VAL . 20.4 t -67.7 -43.25 86.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.793 179.615 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.81 -45.37 86.2 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.442 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.74 -42.75 99.38 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.315 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.789 ' O ' HG23 ' A' ' 35' ' ' VAL . 7.8 tmtt? -69.92 -49.72 49.24 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.267 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.654 HG23 ' O ' ' A' ' 28' ' ' VAL . 47.6 t -61.55 -40.91 88.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 CA-C-N 116.663 -0.244 . . . . 0.0 111.476 -179.611 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.726 HG23 ' HG3' ' A' ' 38' ' ' GLN . 22.3 m -58.62 -41.26 85.49 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.088 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 34.8 m -72.56 -37.39 68.24 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 111.524 0.194 . . . . 0.0 111.524 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.789 HG23 ' O ' ' A' ' 31' ' ' LYS . 47.1 t -61.23 -52.7 58.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 N-CA-C 111.876 0.325 . . . . 0.0 111.876 -179.425 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -98.16 -15.85 19.75 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -178.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.401 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 95.14 -156.9 21.88 Favored Glycine 0 C--N 1.334 0.457 0 C-N-CA 120.598 -0.81 . . . . 0.0 112.349 -179.28 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.726 ' HG3' HG23 ' A' ' 33' ' ' THR . 0.9 OUTLIER -144.74 158.48 53.14 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.456 0.169 . . . . 0.0 111.056 179.915 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -89.61 132.48 9.74 Favored 'Cis proline' 0 C--N 1.349 0.595 0 C-N-CA 123.771 -1.345 . . . . 0.0 112.889 0.138 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.401 HD12 ' O ' ' A' ' 37' ' ' GLY . 29.2 mt -138.53 135.45 35.08 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.012 179.787 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -114.73 139.52 49.62 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.049 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.594 ' HB3' HD12 ' A' ' 53' ' ' LEU . 5.7 mt -80.81 108.89 14.86 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.945 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.8 m80 -114.0 120.42 40.58 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.116 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.592 ' CD2' HD21 ' A' ' 53' ' ' LEU . 0.5 OUTLIER -88.88 129.53 35.58 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.854 179.721 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 17.6 mtp -125.8 117.8 24.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.53 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 20.0 m-20 -79.18 -54.25 6.17 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.794 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -172.9 -61.34 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.353 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -107.46 -24.76 11.7 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.434 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.576 HD22 HD11 ' A' ' 51' ' ' ILE . 0.3 OUTLIER -110.59 149.84 29.82 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.865 0.364 . . . . 0.0 111.389 -179.681 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.53 122.36 45.46 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.001 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.576 HD11 HD22 ' A' ' 49' ' ' LEU . 28.7 mm -114.37 131.36 66.62 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.785 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.61 HD23 ' N ' ' A' ' 53' ' ' LEU . 4.7 tt -94.78 130.52 41.29 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.783 0.325 . . . . 0.0 111.024 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.61 ' N ' HD23 ' A' ' 52' ' ' LEU . 0.7 OUTLIER -81.79 95.32 7.25 Favored 'General case' 0 CA--C 1.527 0.086 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.379 179.37 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -84.71 -36.03 22.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.122 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.1 m-20 -144.67 -179.73 6.76 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.936 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.577 ' HA ' HD12 ' A' ' 59' ' ' LEU . 13.3 tp60 -58.41 -33.41 69.63 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.8 179.459 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -53.16 -41.65 65.38 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.201 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -64.53 -40.96 96.57 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.769 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.577 HD12 ' HA ' ' A' ' 56' ' ' GLN . 11.0 mt -65.52 -42.0 92.53 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.008 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.414 ' HA ' HD12 ' A' ' 63' ' ' ILE . 4.5 m-20 -60.93 -39.81 90.83 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.91 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -68.24 -39.48 82.27 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.642 178.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.442 ' HB1' ' CZ ' ' A' ' 44' ' ' TYR . . . -65.65 -43.67 88.68 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.558 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.414 HD12 ' HA ' ' A' ' 60' ' ' ASP . 8.2 mt -62.81 -40.97 90.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 116.701 -0.227 . . . . 0.0 110.771 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -52.86 -34.97 56.8 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.24 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 30.6 mm -66.65 -45.37 88.54 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.07 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.0 mt -66.77 -45.14 79.46 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.988 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.12 -40.16 94.96 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.004 179.744 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -63.21 -35.23 79.63 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.129 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.8 t -70.48 122.14 19.1 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.899 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.74 -36.01 75.73 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.222 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 32.3 p -70.64 -81.06 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.907 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.3 tmm? 64.04 160.01 0.1 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.064 0.459 . . . . 0.0 111.696 179.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.34 -59.72 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.367 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 m -155.52 174.77 14.79 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.574 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.4 mp -91.95 131.66 37.1 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.413 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -95.7 74.78 3.18 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.136 0.493 . . . . 0.0 111.199 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.46 HG12 ' CE2' ' A' ' 44' ' ' TYR . 25.6 mt -103.92 129.22 56.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.819 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.9 tt -113.38 118.25 34.03 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.103 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.3 pp -104.19 131.55 51.37 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.706 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.4 pp -118.8 159.72 23.21 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.067 0.46 . . . . 0.0 111.334 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -90.72 147.6 23.15 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.77 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 -77.93 5.46 9.69 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -83.86 -167.05 1.58 Allowed 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.511 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 10.6 mtt85 -128.63 104.05 7.44 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.698 0.285 . . . . 0.0 111.215 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.4 p-10 -114.85 34.15 4.98 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.143 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -89.24 159.64 17.33 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.049 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -144.15 163.18 34.35 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.274 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 69.1 m80 -139.72 117.76 11.83 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.174 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 41.7 m80 -141.21 34.98 1.7 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.248 179.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -141.69 163.75 32.08 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.03 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 8.9 m80 -97.81 32.73 2.26 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.208 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -154.66 34.35 0.4 Allowed 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.012 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 1.4 t60 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.098 -0.953 . . . . 0.0 110.973 179.969 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 . . . . . 0 N--CA 1.491 1.579 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 m 63.03 72.44 0.49 Allowed 'General case' 0 CA--C 1.529 0.143 0 CA-C-O 121.128 0.489 . . . . 0.0 111.028 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -167.04 82.24 0.23 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.302 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.616 HG23 ' HG3' ' A' ' 21' ' ' ARG . 36.2 t -79.86 125.14 38.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.868 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.3 mtm105 -94.36 106.34 18.32 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.699 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.7 mp -101.92 134.43 42.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.997 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.8 mttm -100.34 118.09 35.89 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.714 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.492 ' CD1' HD12 ' A' ' 17' ' ' ILE . 93.2 m-85 -107.39 131.88 53.78 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.146 -179.762 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -126.58 131.94 51.41 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.212 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 9.0 t-160 -139.49 121.08 15.2 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.529 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.0 m-20 57.25 31.64 20.41 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.221 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.11 -30.22 7.87 Favored Glycine 0 CA--C 1.524 0.609 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.937 -179.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -65.61 140.57 58.53 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.761 0.315 . . . . 0.0 111.187 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -103.69 154.97 18.95 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.32 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.2 tpp180 -151.76 144.23 24.15 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.069 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.3 mt -113.66 127.64 70.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.001 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.492 HD12 ' CD1' ' A' ' 8' ' ' PHE . 20.1 mt -138.39 125.61 27.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-O 120.784 0.326 . . . . 0.0 111.29 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -112.49 131.07 55.77 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.042 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -128.07 126.8 41.93 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.75 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.3 t -68.3 128.11 35.38 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.946 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.616 ' HG3' HG23 ' A' ' 4' ' ' VAL . 8.6 mtm180 -71.35 150.83 94.21 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.062 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -74.62 125.76 11.62 Favored 'Cis proline' 0 C--N 1.35 0.645 0 C-N-CA 123.517 -1.451 . . . . 0.0 112.308 0.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.5 p -73.58 131.91 34.19 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.04 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.504 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -96.98 127.14 42.66 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.154 -179.762 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.484 ' OH ' HD22 ' A' ' 42' ' ' LEU . 71.3 t80 -53.95 -43.72 70.1 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.076 179.565 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.406 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 1.4 mm-40 -60.97 -38.85 87.38 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.087 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -69.17 -44.27 72.58 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.124 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 24' ' ' LYS . 22.0 t -63.76 -47.24 91.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.019 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.406 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 11.5 pt-20 -63.91 -36.75 84.96 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.186 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -56.68 -45.22 81.87 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.583 0.23 . . . . 0.0 111.061 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.574 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.3 OUTLIER -68.89 -48.84 62.36 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.325 179.819 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 50.0 t -62.63 -40.58 88.92 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.538 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.73 HG23 ' HB3' ' A' ' 38' ' ' GLN . 79.9 m -61.01 -47.26 87.27 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.896 -0.138 . . . . 0.0 111.269 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.0 m -72.88 -44.52 61.21 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 31' ' ' LYS . 70.1 t -67.1 -44.8 87.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.235 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.575 ' HB2' HD11 ' A' ' 40' ' ' LEU . 15.9 m-85 -100.28 7.06 44.65 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.09 172.7 23.59 Favored Glycine 0 C--N 1.339 0.704 0 C-N-CA 120.503 -0.856 . . . . 0.0 112.88 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.73 ' HB3' HG23 ' A' ' 33' ' ' THR . 6.8 pt20 -135.04 154.65 79.23 Favored Pre-proline 0 C--O 1.234 0.242 0 O-C-N 122.853 -0.204 . . . . 0.0 110.98 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.43 ' HG2' ' HB3' ' A' ' 82' ' ' GLN . 95.7 Cg_endo -88.02 153.61 38.33 Favored 'Cis proline' 0 C--N 1.35 0.609 0 C-N-CA 123.567 -1.43 . . . . 0.0 113.338 0.544 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.575 HD11 ' HB2' ' A' ' 36' ' ' PHE . 15.7 mt -124.6 160.4 28.51 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.08 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -111.46 126.3 54.8 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.661 179.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.484 HD22 ' OH ' ' A' ' 25' ' ' TYR . 5.2 mp -90.23 96.24 10.57 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.818 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -115.22 122.98 47.66 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.284 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.537 ' HB2' HD21 ' A' ' 53' ' ' LEU . 11.7 t80 -105.79 129.4 53.99 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.691 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -131.27 120.73 23.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.731 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -85.02 -68.42 0.73 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.851 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -149.08 -74.61 0.17 Allowed 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.393 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -110.1 4.66 21.4 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.433 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.465 HD12 HD11 ' A' ' 51' ' ' ILE . 0.6 OUTLIER -130.12 140.03 50.84 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.792 0.329 . . . . 0.0 111.277 -179.917 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -115.23 128.3 56.06 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.712 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.465 HD11 HD12 ' A' ' 49' ' ' LEU . 18.8 mt -128.39 134.26 65.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.958 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 39.8 mt -93.85 132.81 37.9 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.941 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.537 HD21 ' HB2' ' A' ' 44' ' ' TYR . 0.8 OUTLIER -122.95 88.04 2.86 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.011 0.434 . . . . 0.0 111.26 179.719 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.92 -32.51 14.54 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.969 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -100.87 166.64 10.74 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.982 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -31.98 73.44 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.027 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -56.82 -50.11 73.35 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.063 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -63.09 -45.02 94.1 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.822 0.344 . . . . 0.0 110.802 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.3 tp -58.59 -45.88 88.16 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.022 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.63 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.4 OUTLIER -63.79 -42.18 97.79 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.012 179.892 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.8 tmtt? -62.34 -38.63 90.21 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.729 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.74 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -62.42 -39.88 94.75 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.54 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.63 HD12 ' HA ' ' A' ' 60' ' ' ASP . 12.7 mt -63.57 -43.73 98.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-O 120.606 0.241 . . . . 0.0 110.881 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -56.17 -39.5 72.43 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.11 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.74 HD12 ' HA ' ' A' ' 62' ' ' ALA . 12.4 mt -64.03 -45.03 97.83 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.907 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.638 HD13 HD12 ' A' ' 75' ' ' LEU . 5.5 tt -61.85 -47.35 85.45 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.673 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -58.6 -40.31 82.89 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.076 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -33.14 74.02 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.384 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 33.6 t -83.2 119.97 25.22 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.754 0.311 . . . . 0.0 111.208 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.4 p -68.0 -35.37 78.21 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.921 179.286 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.99 -37.08 67.13 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.402 -179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.45 ' SD ' HD12 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -80.89 109.0 15.03 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.711 0.291 . . . . 0.0 111.132 -179.844 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.77 -31.99 7.24 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.784 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.2 m -122.15 154.35 37.54 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.656 0.265 . . . . 0.0 110.948 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.638 HD12 HD13 ' A' ' 66' ' ' LEU . 1.1 mp -92.74 117.35 29.91 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.174 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.74 86.1 3.99 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.384 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.9 mt -102.26 131.79 49.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.681 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 41.8 tp -102.12 117.25 34.38 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.755 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.7 pp -104.87 126.95 52.48 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.865 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.8 mp -119.2 122.74 42.67 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.849 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.526 ' HA ' HD23 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -74.75 142.84 44.3 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.153 -179.89 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLN . . . . . 0.43 ' HB3' ' HG2' ' A' ' 39' ' ' PRO . 0.3 OUTLIER -85.39 5.63 30.05 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.904 179.584 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -138.98 167.39 22.15 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.954 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 4.7 mtt-85 -106.53 -34.91 7.23 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.255 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -98.14 142.43 29.84 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.799 0.333 . . . . 0.0 110.941 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.3 mt -102.59 138.37 39.59 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.179 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -119.53 166.04 13.63 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.198 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 19.6 t60 63.72 87.09 0.11 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.447 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 5.2 m170 -133.22 115.34 14.88 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.046 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 8.4 m170 -101.63 -66.42 0.92 Allowed 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.783 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -138.4 146.71 42.54 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.807 0.337 . . . . 0.0 111.05 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -139.78 169.21 18.14 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.387 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.554 -0.736 . . . . 0.0 111.135 179.821 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.428 0 CA-C-O 121.096 0.474 . . . . 0.0 111.162 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.4 m 57.82 72.54 0.51 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.191 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -158.5 155.92 29.32 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.403 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.445 HG12 HD21 ' A' ' 75' ' ' LEU . 17.6 t -150.09 128.26 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.993 179.652 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -97.09 116.27 29.0 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.637 0.256 . . . . 0.0 110.963 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.735 HG12 HD11 ' A' ' 75' ' ' LEU . 21.7 mt -107.52 118.16 54.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.183 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.492 ' CD ' ' HB3' ' A' ' 74' ' ' SER . 0.0 OUTLIER -95.03 109.59 21.61 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.71 179.786 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -104.28 142.25 34.86 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.154 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -134.47 124.24 25.28 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.886 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -142.28 121.21 12.8 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.699 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 62.1 t30 57.16 34.0 24.18 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.88 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 91.02 -32.23 5.25 Favored Glycine 0 C--N 1.337 0.622 0 C-N-CA 121.047 -0.596 . . . . 0.0 113.075 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.35 136.86 55.47 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.836 0.35 . . . . 0.0 111.247 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -114.19 142.6 46.04 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.946 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.8 mtm-85 -134.11 140.49 46.63 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.172 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.461 HD12 ' HE2' ' A' ' 7' ' ' LYS . 25.9 mm -114.1 117.44 55.52 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.003 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.1 mt -125.78 137.89 56.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.215 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -110.54 133.94 52.84 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.172 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -125.4 122.83 37.86 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.196 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.88 158.49 19.31 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.042 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.05 154.95 40.58 Favored Pre-proline 0 CA--C 1.531 0.245 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.955 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -76.7 126.6 13.55 Favored 'Cis proline' 0 C--N 1.351 0.71 0 C-N-CA 123.396 -1.502 . . . . 0.0 112.737 -0.057 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.5 p -90.07 146.82 5.72 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.335 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.652 ' O ' HG23 ' A' ' 28' ' ' VAL . 4.5 mtpt -120.82 143.66 48.75 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.098 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 24.3 t80 -54.79 -52.97 60.98 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.077 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.445 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 0.3 OUTLIER -61.1 -34.82 75.55 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.163 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.33 -43.54 77.29 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.139 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.668 ' O ' HG23 ' A' ' 32' ' ' VAL . 43.5 t -63.18 -47.63 91.44 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.126 0 CA-C-N 116.693 -0.231 . . . . 0.0 111.146 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.445 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 9.3 pt-20 -64.49 -37.9 89.13 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.276 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -49.03 76.55 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.722 -0.217 . . . . 0.0 110.892 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.66 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.1 OUTLIER -67.74 -48.96 64.98 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.278 179.861 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.668 HG23 ' O ' ' A' ' 28' ' ' VAL . 43.0 t -59.17 -41.44 83.73 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 116.678 -0.237 . . . . 0.0 111.358 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 99.4 m -65.01 -41.45 95.32 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.908 -0.133 . . . . 0.0 111.042 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.9 m -72.76 -43.71 62.53 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 121.108 -0.237 . . . . 0.0 111.617 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' ' 31' ' ' LYS . 48.5 t -66.47 -49.67 73.41 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 N-CA-C 111.574 0.213 . . . . 0.0 111.574 -179.411 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -88.71 -10.72 47.41 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -179.08 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.5 ' O ' HD13 ' A' ' 40' ' ' LEU . . . 91.21 -176.89 40.8 Favored Glycine 0 C--N 1.338 0.65 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.575 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.416 ' HA ' HD12 ' A' ' 40' ' ' LEU . 1.0 OUTLIER -145.19 156.31 54.35 Favored Pre-proline 0 N--CA 1.465 0.285 0 CA-C-O 120.528 0.204 . . . . 0.0 110.83 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.527 ' C ' HD12 ' A' ' 40' ' ' LEU . 92.0 Cg_endo -93.25 128.22 5.12 Favored 'Cis proline' 0 C--N 1.351 0.699 0 C-N-CA 123.918 -1.284 . . . . 0.0 112.933 0.099 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.801 HD23 HD13 ' A' ' 79' ' ' LEU . 6.3 mp -134.57 139.98 45.78 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.992 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.66 139.47 38.2 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.137 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.576 HD21 HG11 ' A' ' 32' ' ' VAL . 0.8 OUTLIER -91.06 106.47 18.54 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.213 -179.8 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -101.65 118.98 38.05 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.251 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.418 ' OH ' ' HB1' ' A' ' 62' ' ' ALA . 2.2 t80 -88.95 118.5 28.72 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.822 179.652 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.684 ' HB2' HD21 ' A' ' 78' ' ' LEU . 0.9 OUTLIER -130.63 116.16 17.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.764 179.891 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -80.85 -50.35 9.9 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.791 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.45 -63.7 0.02 OUTLIER 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.61 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.6 mp0 -109.54 -24.12 11.15 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.726 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.7 mp -103.4 138.83 39.6 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.79 0.328 . . . . 0.0 111.317 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 87.2 p -114.32 121.62 44.19 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.87 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.5 mp -124.44 134.28 67.12 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.712 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 14.6 tp -98.96 124.91 44.23 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.771 -0.195 . . . . 0.0 110.705 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.486 HD22 HD23 ' A' ' 59' ' ' LEU . 1.5 mt -65.0 103.42 0.73 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.912 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.1 mtmm -103.1 -31.78 9.99 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.703 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -148.08 173.85 12.52 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.779 0.323 . . . . 0.0 111.465 -179.414 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.468 ' HA ' HD12 ' A' ' 59' ' ' LEU . 1.3 mt-30 -56.94 -29.72 63.4 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.138 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -53.08 -41.74 65.19 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.036 179.747 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -68.39 -40.67 81.28 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.761 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.486 HD23 HD22 ' A' ' 53' ' ' LEU . 36.5 mt -63.52 -40.28 96.62 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.526 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.87 ' HA ' HD12 ' A' ' 63' ' ' ILE . 1.2 t0 -67.22 -37.62 83.9 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.163 179.627 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.47 -36.69 83.28 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.769 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.418 ' HB1' ' OH ' ' A' ' 44' ' ' TYR . . . -62.84 -37.71 87.86 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.185 179.344 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.87 HD12 ' HA ' ' A' ' 60' ' ' ASP . 11.1 mt -63.84 -44.29 98.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.951 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.03 -39.34 69.02 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.063 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 29.5 mt -66.79 -42.97 90.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.015 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 40.4 mt -67.45 -46.41 73.15 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.139 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -60.98 -38.94 87.76 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.369 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -65.69 -32.68 74.37 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.427 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 33.8 t -109.26 93.59 4.59 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.959 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.8 m -59.48 -27.28 65.98 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.765 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.0 t -57.67 -35.39 70.5 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.542 0.21 . . . . 0.0 111.282 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -117.21 163.17 16.7 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.762 0.315 . . . . 0.0 111.251 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -162.24 36.56 0.12 Allowed 'General case' 0 C--O 1.235 0.342 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.265 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.492 ' HB3' ' CD ' ' A' ' 7' ' ' LYS . 0.9 OUTLIER -143.18 149.11 37.57 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.708 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.735 HD11 HG12 ' A' ' 6' ' ' ILE . 0.1 OUTLIER -111.58 132.92 54.2 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.855 179.78 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.81 119.45 36.43 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.956 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.436 HD11 HD12 ' A' ' 75' ' ' LEU . 16.0 mt -128.45 118.33 47.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.873 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.684 HD21 ' HB2' ' A' ' 45' ' ' MET . 0.4 OUTLIER -106.3 122.17 45.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.955 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.801 HD13 HD23 ' A' ' 40' ' ' LEU . 3.0 pp -114.36 135.85 53.63 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.691 179.689 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.485 ' N ' HD12 ' A' ' 80' ' ' LEU . 3.0 mp -114.3 144.35 43.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.792 -179.636 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -98.84 136.55 38.7 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.008 0.433 . . . . 0.0 110.999 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.51 6.05 39.66 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.123 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 8.4 p30 -61.97 87.86 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.005 0.431 . . . . 0.0 111.101 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? 59.01 35.38 24.01 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.3 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 68.37 170.7 0.28 Allowed 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.241 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -110.98 154.45 24.12 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.852 0.358 . . . . 0.0 111.414 -179.666 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.32 133.4 43.85 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.257 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -152.84 -55.11 0.12 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.136 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 67.75 -75.3 0.06 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.392 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -154.57 -57.96 0.11 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.546 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -139.51 164.3 30.25 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.183 179.674 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -162.0 -49.64 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.99 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.233 -0.889 . . . . 0.0 111.498 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 120.71 0.291 . . . . 0.0 111.406 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.4 t -108.03 78.82 1.21 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.07 0.462 . . . . 0.0 111.031 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -114.88 172.34 7.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.18 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.2 t -131.34 129.0 62.11 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.966 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.443 ' NH1' HG22 ' A' ' 16' ' ' ILE . 5.8 mtt-85 -88.5 112.72 23.31 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.952 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.555 HD12 ' HD2' ' A' ' 19' ' ' PHE . 6.2 mt -106.33 128.65 60.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.956 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.5 mtpt -104.04 125.23 50.23 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.586 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.502 ' CE1' HD12 ' A' ' 17' ' ' ILE . 20.6 m-85 -109.21 144.54 37.18 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.213 -179.585 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -121.77 124.0 43.16 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.294 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.676 ' HB2' HD11 ' A' ' 79' ' ' LEU . 12.1 t-160 -141.2 115.83 9.6 Favored 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.438 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 56.8 m-20 58.21 30.9 20.1 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 120.818 0.342 . . . . 0.0 111.137 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.9 -2.79 87.7 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 121.105 -0.569 . . . . 0.0 113.296 -179.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -85.64 143.08 28.63 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 117.216 0.508 . . . . 0.0 110.886 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.01 137.74 43.41 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.12 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -133.94 133.78 41.8 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.788 179.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.443 HG22 ' NH1' ' A' ' 5' ' ' ARG . 3.4 mp -114.07 117.29 55.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.073 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.502 HD12 ' CE1' ' A' ' 8' ' ' PHE . 10.9 mt -129.38 131.36 67.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.157 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -102.81 145.41 29.8 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.136 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.555 ' HD2' HD12 ' A' ' 6' ' ' ILE . 46.2 m-85 -138.84 116.9 11.71 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.031 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.4 p -78.98 135.84 37.04 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.031 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.1 mtt180 -74.87 152.81 86.87 Favored Pre-proline 0 CA--C 1.531 0.243 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.844 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -72.79 129.04 16.46 Favored 'Cis proline' 0 C--N 1.35 0.611 0 C-N-CA 123.763 -1.349 . . . . 0.0 112.426 0.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.431 ' O ' HG13 ' A' ' 23' ' ' VAL . 15.0 p -99.94 118.8 47.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.163 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.495 ' O ' HG23 ' A' ' 28' ' ' VAL . 11.0 mmmt -91.32 132.44 36.17 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.979 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.52 ' CD2' HD22 ' A' ' 59' ' ' LEU . 38.6 t80 -54.44 -41.64 69.64 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.704 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -59.32 -45.32 91.64 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.051 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.69 -44.63 85.59 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.121 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.677 ' O ' HG23 ' A' ' 32' ' ' VAL . 38.9 t -62.91 -47.94 90.39 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.918 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -60.78 -41.61 95.91 Favored 'General case' 0 N--CA 1.461 0.1 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.936 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -57.23 -48.43 78.85 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.119 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.692 ' O ' HG23 ' A' ' 35' ' ' VAL . 4.9 tttt -68.62 -49.5 58.71 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.257 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.677 HG23 ' O ' ' A' ' 28' ' ' VAL . 45.6 t -58.4 -44.67 89.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 CA-C-N 116.814 -0.176 . . . . 0.0 111.295 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 91.1 m -66.79 -39.38 87.76 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.192 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.4 m -72.15 -43.24 64.94 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.692 HG23 ' O ' ' A' ' 31' ' ' LYS . 60.6 t -64.92 -51.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-O 120.463 0.173 . . . . 0.0 111.246 -179.515 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -83.67 -20.37 33.67 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -179.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.525 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 100.08 -179.77 29.95 Favored Glycine 0 C--N 1.338 0.656 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.521 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -139.55 156.36 71.39 Favored Pre-proline 0 N--CA 1.464 0.26 0 O-C-N 122.73 -0.276 . . . . 0.0 111.175 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.41 ' HG2' ' HB2' ' A' ' 82' ' ' GLN . 95.2 Cg_endo -85.75 137.04 21.62 Favored 'Cis proline' 0 C--N 1.35 0.621 0 C-N-CA 123.438 -1.484 . . . . 0.0 112.897 0.091 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.525 HD12 ' O ' ' A' ' 37' ' ' GLY . 47.4 mt -137.9 130.07 28.96 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.515 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -103.68 138.78 39.84 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.9 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.579 HD21 HG11 ' A' ' 32' ' ' VAL . 4.2 mt -95.62 110.4 22.51 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.786 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -111.09 126.71 55.12 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.954 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.469 ' HD2' HD22 ' A' ' 53' ' ' LEU . 0.5 OUTLIER -89.14 126.33 35.42 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.722 179.736 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -131.2 118.55 20.59 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.617 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -83.61 -58.99 2.58 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.675 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -175.31 -52.29 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.544 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -109.37 -30.6 7.89 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.542 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.9 mp -112.41 154.77 25.27 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.788 0.328 . . . . 0.0 111.222 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -121.27 126.78 50.4 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.91 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 28.3 mm -113.75 134.44 56.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.859 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -96.59 126.7 41.95 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.792 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.614 HD13 HD13 ' A' ' 59' ' ' LEU . 0.5 OUTLIER -99.37 87.33 3.59 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 121.045 0.45 . . . . 0.0 110.835 179.939 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.3 mtpp -105.03 -34.2 8.06 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.138 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -103.92 163.49 12.33 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 120.78 0.324 . . . . 0.0 110.973 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.1 tm0? -63.34 -37.95 89.25 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.799 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.55 -38.54 84.82 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.206 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.62 -49.92 75.57 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.04 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.614 HD13 HD13 ' A' ' 53' ' ' LEU . 13.0 tp -63.89 -40.94 97.68 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.93 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.561 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.4 OUTLIER -67.06 -37.62 84.35 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.213 179.726 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -62.66 -39.35 93.63 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.665 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.75 -38.27 90.47 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.088 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.619 ' HA ' HD12 ' A' ' 66' ' ' LEU . 25.2 mt -65.49 -41.9 92.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.141 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.45 -39.59 67.57 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.037 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 45.1 mt -64.7 -38.37 82.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.949 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.728 HD11 ' HG ' ' A' ' 75' ' ' LEU . 15.9 mt -64.17 -45.37 88.73 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.828 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.86 -32.63 69.62 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.302 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.1 mtt-85 -66.09 -31.81 72.9 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.119 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.5 t -104.02 112.07 24.9 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.241 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.71 -33.4 71.57 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.461 179.49 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.8 p -72.79 -71.08 0.31 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.432 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.74 106.32 6.24 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 120.842 0.353 . . . . 0.0 111.384 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 25.1 pttt -114.74 -35.84 4.71 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.483 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.87 170.3 11.4 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 120.714 0.292 . . . . 0.0 111.526 -179.649 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.728 ' HG ' HD11 ' A' ' 66' ' ' LEU . 6.2 mp -114.9 133.5 55.93 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.399 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -102.6 81.45 2.03 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.517 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.5 mt -106.42 129.64 59.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.016 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.2 pp -109.03 132.65 53.91 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.023 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.676 HD11 ' HB2' ' A' ' 10' ' ' HIS . 3.1 pp -111.15 135.9 50.99 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.634 179.587 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.6 mt -112.57 146.9 37.73 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.168 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.5 t -94.57 147.89 22.81 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.811 179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLN . . . . . 0.41 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 1.7 mm-40 -80.07 5.28 14.63 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 112.378 0.511 . . . . 0.0 112.378 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 -125.6 70.84 1.2 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.909 0.385 . . . . 0.0 110.436 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.77 46.03 1.13 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.705 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -97.31 135.43 39.23 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.485 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 21.9 mt 66.63 172.72 0.25 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.049 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 58.88 90.0 0.05 Allowed 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.819 0.342 . . . . 0.0 111.381 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -121.76 109.73 15.07 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.213 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 71.8 t60 -127.14 -78.98 0.59 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.547 179.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 8.3 t60 43.77 77.23 0.07 Allowed 'General case' 0 C--O 1.234 0.288 0 C-N-CA 122.608 0.363 . . . . 0.0 111.617 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 65.24 -169.87 0.2 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.954 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -156.75 132.88 9.75 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.621 0.248 . . . . 0.0 111.402 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 67.7 m-70 . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.447 -0.787 . . . . 0.0 110.775 179.857 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 . . . . . 0 N--CA 1.489 1.494 0 CA-C-O 120.777 0.323 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.0 m -89.27 175.7 7.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.764 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 72.07 126.66 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.841 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.657 HG21 ' NH2' ' A' ' 21' ' ' ARG . 21.3 t -134.37 146.78 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.616 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -93.67 133.08 37.4 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.981 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.483 HD12 ' CD1' ' A' ' 19' ' ' PHE . 29.7 mt -114.76 136.4 51.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.918 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.7 mttt -108.25 122.39 46.84 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.753 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -116.66 139.89 50.02 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.873 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.649 ' HB2' HD12 ' A' ' 78' ' ' LEU . 0.3 OUTLIER -119.34 131.37 55.71 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.1 -179.826 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.6 t-160 -136.01 114.7 11.96 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.658 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 57.72 35.14 25.28 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.218 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 95.23 -35.22 4.38 Favored Glycine 0 C--N 1.337 0.635 0 C-N-CA 120.915 -0.66 . . . . 0.0 113.005 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.39 150.47 48.24 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.611 0.243 . . . . 0.0 111.135 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -118.37 141.01 48.97 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.221 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 91.9 mtt-85 -129.14 147.77 51.02 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.1 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 19.2 mt -115.03 126.45 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.087 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 9.2 tp -140.22 135.31 36.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.278 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -101.85 141.19 35.08 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.14 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.483 ' CD1' HD12 ' A' ' 6' ' ' ILE . 9.5 m-85 -126.52 153.05 45.69 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.119 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 47.5 t -95.31 142.84 27.24 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.19 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.657 ' NH2' HG21 ' A' ' 4' ' ' VAL . 0.2 OUTLIER -97.12 140.85 22.31 Favored Pre-proline 0 CA--C 1.53 0.208 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.633 179.627 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.409 ' HA ' ' CG ' ' A' ' 21' ' ' ARG . 4.0 Cg_exo -74.6 143.89 79.24 Favored 'Cis proline' 0 C--N 1.351 0.695 0 C-N-CA 123.78 -1.342 . . . . 0.0 112.676 0.172 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.0 p -105.99 133.79 49.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.908 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.522 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -97.9 142.71 29.3 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.924 -179.664 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -60.34 -43.7 96.2 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.979 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -60.05 -41.88 93.29 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.951 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.95 -44.48 92.68 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.328 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.695 ' O ' HG23 ' A' ' 32' ' ' VAL . 33.4 t -67.28 -47.47 81.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.78 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -57.87 -45.78 85.82 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.161 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -56.87 -47.3 80.75 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.102 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.716 ' O ' HG23 ' A' ' 35' ' ' VAL . 25.9 tttt -67.09 -49.57 64.54 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.17 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.695 HG23 ' O ' ' A' ' 28' ' ' VAL . 47.9 t -58.26 -44.76 88.76 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.344 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 87.7 m -61.2 -40.42 93.88 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.151 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 20.5 m -72.54 -42.93 64.19 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 111.525 0.194 . . . . 0.0 111.525 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.716 HG23 ' O ' ' A' ' 31' ' ' LYS . 62.1 t -62.54 -52.23 62.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.421 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -87.09 -18.77 29.73 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -179.182 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 98.11 179.66 32.78 Favored Glycine 0 C--N 1.337 0.622 0 C-N-CA 120.65 -0.785 . . . . 0.0 112.612 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.3 pm0 -140.36 154.14 69.38 Favored Pre-proline 0 N--CA 1.465 0.315 0 O-C-N 122.863 -0.198 . . . . 0.0 110.927 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -83.3 143.87 48.6 Favored 'Cis proline' 0 C--N 1.35 0.618 0 C-N-CA 123.525 -1.448 . . . . 0.0 113.033 0.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.744 HD13 HD13 ' A' ' 79' ' ' LEU . 17.8 mt -138.52 138.93 38.5 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.155 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -104.83 119.44 39.01 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.987 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.84 113.63 22.14 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.943 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -114.08 119.52 37.41 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.135 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -101.85 129.76 48.15 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.694 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.66 133.33 55.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.785 179.586 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -83.32 -59.65 2.39 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.521 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -149.97 -65.11 0.21 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.408 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.481 ' O ' HD22 ' A' ' 49' ' ' LEU . 3.2 mp0 -123.21 10.74 9.35 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.54 179.621 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.481 HD22 ' O ' ' A' ' 48' ' ' GLU . 3.9 mm? -126.75 164.77 20.6 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.625 0.25 . . . . 0.0 111.114 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -121.06 118.43 29.77 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.888 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 22.3 mt -120.17 133.06 68.12 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.991 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.31 122.75 45.45 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.86 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.52 91.82 6.97 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.722 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.8 -32.17 16.2 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.397 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -116.1 162.33 17.58 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.758 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -62.31 -31.36 71.97 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.991 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -53.45 -46.0 69.72 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.771 0.319 . . . . 0.0 110.815 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.38 -37.36 87.22 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.299 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.65 HD13 ' C ' ' A' ' 59' ' ' LEU . 1.2 tm? -61.24 -47.14 87.41 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.482 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.425 ' N ' HD13 ' A' ' 59' ' ' LEU . 31.4 t70 -68.39 -32.15 72.02 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.151 179.548 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.0 tttm -62.64 -38.44 90.28 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.765 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.602 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -65.76 -36.11 82.62 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.069 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 36.4 mm -59.36 -47.78 89.38 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.836 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -55.49 -42.61 74.65 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.917 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.602 HD12 ' HA ' ' A' ' 62' ' ' ALA . 9.9 mt -67.73 -43.09 86.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.141 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.959 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 13.9 tp -58.74 -45.57 89.37 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.83 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -65.83 -32.65 74.29 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.18 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.6 mmt180 -64.69 -33.51 76.13 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.32 179.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 42.2 t -103.36 111.25 23.58 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.184 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 51.6 p -62.49 -39.97 95.19 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.968 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 32.8 p -61.14 -34.65 75.34 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.435 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.5 ttp -90.89 92.52 8.81 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.715 0.293 . . . . 0.0 110.99 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -97.86 -34.63 10.78 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.169 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.2 m -92.2 166.71 12.49 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.838 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.8 mt -97.53 120.72 38.42 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.964 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -89.66 84.51 6.32 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.684 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 15.2 mt -117.72 124.14 72.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.126 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.649 HD12 ' HB2' ' A' ' 9' ' ' GLU . 1.3 tp -111.38 117.37 32.91 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.813 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.744 HD13 HD13 ' A' ' 40' ' ' LEU . 3.3 pp -103.3 136.18 43.56 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.847 0.356 . . . . 0.0 111.158 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.7 mp -119.26 158.13 26.66 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.156 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.635 ' HA ' HD23 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -88.91 137.1 32.62 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.076 179.839 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 48.4 tp60 -88.09 4.62 44.66 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.806 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -139.5 25.84 2.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.913 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 5.4 mtm180 -167.16 82.83 0.22 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.011 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -140.67 133.79 29.45 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.136 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.6 mt -174.72 -38.35 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.292 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -54.98 158.37 2.83 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.944 0.402 . . . . 0.0 111.957 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -78.16 172.99 12.73 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.472 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 40.3 t60 -108.66 -53.15 2.67 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.203 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.3 m80 65.48 100.12 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.631 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' HIS . . . . . 0.401 ' O ' ' HB2' ' A' ' 92' ' ' HIS . 0.2 OUTLIER -107.57 168.28 9.36 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.976 179.945 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 92' ' ' HIS . . . . . 0.401 ' HB2' ' O ' ' A' ' 91' ' ' HIS . 13.0 m170 68.41 -76.28 0.06 Allowed 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 122.913 0.485 . . . . 0.0 111.198 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 39.1 t60 . . . . . 0 C--O 1.251 1.155 0 CA-C-O 118.341 -0.838 . . . . 0.0 110.8 179.705 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 120.627 0.251 . . . . 0.0 111.345 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.425 ' O ' ' HB2' ' A' ' 3' ' ' ASP . 61.7 p -170.54 161.84 7.89 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.815 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.425 ' HB2' ' O ' ' A' ' 2' ' ' SER . 1.1 m-20 69.53 146.7 0.06 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.407 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.7 t -140.16 127.38 23.62 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.003 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.1 120.08 28.0 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.917 0.389 . . . . 0.0 111.172 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.831 HG23 HD12 ' A' ' 77' ' ' ILE . 30.2 mm -106.27 117.7 52.52 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.055 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.0 mttt -101.87 111.56 23.86 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.541 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.467 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 1.8 p90 -117.0 142.58 46.77 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.179 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -122.39 140.07 53.12 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.444 -179.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.2 t-160 -140.94 113.39 8.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.439 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.2 m120 59.76 31.42 20.81 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.541 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 104.18 -43.95 1.57 Allowed Glycine 0 C--N 1.335 0.505 0 C-N-CA 120.847 -0.692 . . . . 0.0 113.223 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -70.96 135.85 48.14 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.762 0.281 . . . . 0.0 111.119 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -119.24 156.73 29.39 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.787 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.467 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 1.1 tpt180 -141.39 143.74 34.11 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.285 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.412 ' O ' HD13 ' A' ' 17' ' ' ILE . 2.4 mt -116.9 118.93 60.44 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.054 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.412 HD13 ' O ' ' A' ' 16' ' ' ILE . 27.4 mm -129.95 137.58 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-O 120.746 0.308 . . . . 0.0 111.262 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.09 145.95 24.62 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.228 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.479 ' CZ ' HG13 ' A' ' 28' ' ' VAL . 33.8 m-85 -133.37 117.88 17.79 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.166 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 65.7 m -72.95 136.13 45.13 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.243 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 44.1 mtm180 -100.45 156.83 34.77 Favored Pre-proline 0 CA--C 1.53 0.182 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.006 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.18 122.28 8.11 Favored 'Cis proline' 0 C--N 1.35 0.654 0 C-N-CA 123.258 -1.559 . . . . 0.0 112.657 0.059 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.7 p -104.36 153.23 6.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.168 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -104.81 137.02 43.23 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.685 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -54.88 -37.06 65.81 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.67 179.502 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -58.52 -45.1 89.52 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.002 179.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -67.33 -44.66 78.55 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.161 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.479 HG13 ' CZ ' ' A' ' 19' ' ' PHE . 30.0 t -62.34 -47.32 93.59 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.127 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.85 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.27 -44.25 95.48 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.906 179.583 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -56.8 -40.92 76.83 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.098 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.791 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.3 OUTLIER -67.64 -49.47 62.77 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.167 179.772 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 28' ' ' VAL . 25.5 t -64.79 -41.29 91.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.373 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 96.5 m -60.17 -39.52 86.71 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.158 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 16.5 m -71.89 -29.09 63.97 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 121.238 -0.185 . . . . 0.0 111.344 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 31' ' ' LYS . 44.8 t -69.37 -53.67 23.87 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-O 120.583 0.23 . . . . 0.0 111.449 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -94.18 -11.22 30.83 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -178.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.602 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 101.92 177.39 28.04 Favored Glycine 0 C--N 1.335 0.504 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.646 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -129.46 153.89 80.68 Favored Pre-proline 0 C--O 1.233 0.227 0 CA-C-O 120.623 0.249 . . . . 0.0 111.18 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.429 ' CG ' ' HB2' ' A' ' 84' ' ' ARG . 95.5 Cg_endo -89.12 136.1 12.6 Favored 'Cis proline' 0 C--N 1.349 0.582 0 C-N-CA 123.494 -1.461 . . . . 0.0 112.919 0.203 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.712 HD23 ' HA ' ' A' ' 81' ' ' SER . 55.3 mt -138.03 136.14 36.58 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.722 179.601 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -115.19 140.55 48.99 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.051 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 mp -81.74 112.31 18.79 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.508 179.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -101.36 129.86 47.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 -179.644 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.855 ' HB2' HD21 ' A' ' 53' ' ' LEU . 0.9 OUTLIER -88.88 124.42 34.19 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-O 120.742 0.306 . . . . 0.0 111.32 -179.878 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 4.6 tpp -126.23 107.74 10.64 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.771 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.2 m-20 -78.91 -60.81 2.23 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.863 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -154.92 -59.07 0.11 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.573 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.43 11.78 6.38 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.553 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -131.59 152.49 50.75 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.648 0.261 . . . . 0.0 111.428 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 t -120.18 126.64 51.16 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.924 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.424 ' HB ' ' HB3' ' A' ' 44' ' ' TYR . 3.4 mt -114.1 134.33 57.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.855 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -93.84 126.78 39.23 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.85 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.855 HD21 ' HB2' ' A' ' 44' ' ' TYR . 1.3 mm? -100.54 96.77 7.6 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.033 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.4 tttm -93.98 -32.92 13.64 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.277 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.0 m-20 -136.99 173.2 11.95 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.754 0.311 . . . . 0.0 111.14 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -60.25 -29.81 69.02 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.958 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -53.65 -43.94 69.18 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.093 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -66.88 -38.37 86.17 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.645 179.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.44 -45.32 91.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.162 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.72 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.5 OUTLIER -62.14 -41.32 98.16 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.194 -179.837 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -62.32 -38.82 90.89 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.65 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.406 ' HB1' ' CZ ' ' A' ' 44' ' ' TYR . . . -63.6 -41.32 98.34 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.584 179.697 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.72 HD12 ' HA ' ' A' ' 60' ' ' ASP . 8.2 mt -63.55 -44.63 98.73 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-O 120.66 0.267 . . . . 0.0 110.762 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.39 -42.3 77.7 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.174 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.1 mt -68.02 -42.41 85.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.087 179.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 10.0 tp -59.62 -46.21 89.67 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.976 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.37 -35.62 70.21 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.24 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.62 -31.74 63.7 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.098 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.7 t -64.76 141.42 58.78 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.439 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.5 t -70.3 -30.73 67.8 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.772 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 47.7 p -92.7 37.11 1.01 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.881 0.372 . . . . 0.0 111.484 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -72.0 140.76 49.24 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.977 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -179.04 -43.3 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.073 179.677 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 64.1 m -147.14 178.06 8.68 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.798 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.451 HD13 HD13 ' A' ' 6' ' ' ILE . 6.7 mp -106.72 119.36 39.12 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.89 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.0 ttp180 -82.56 77.94 9.26 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.995 0.426 . . . . 0.0 110.608 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.831 HD12 HG23 ' A' ' 6' ' ' ILE . 22.1 mt -104.4 118.58 51.89 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.883 -179.82 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.648 HD23 HD11 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -102.2 127.42 49.14 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.048 -179.879 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.559 ' O ' HD12 ' A' ' 79' ' ' LEU . 3.3 pp -111.15 131.13 55.35 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.046 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.648 HD11 HD23 ' A' ' 78' ' ' LEU . 1.7 mp -140.87 151.15 44.08 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.873 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.712 ' HA ' HD23 ' A' ' 40' ' ' LEU . 0.4 OUTLIER -67.79 132.7 47.9 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.993 179.92 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.82 5.34 46.57 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.288 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 60.76 100.52 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.777 179.533 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.429 ' HB2' ' CG ' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -144.15 50.59 1.32 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.09 179.963 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 61.62 -177.0 0.12 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.472 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.1 mp -107.46 60.73 0.62 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.697 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.426 ' O ' ' HB2' ' A' ' 88' ' ' HIS . 0.2 OUTLIER 58.47 -166.85 0.15 Allowed 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.859 -179.694 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.426 ' HB2' ' O ' ' A' ' 87' ' ' GLU . 33.8 m170 70.6 136.61 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.863 0.363 . . . . 0.0 110.945 -179.681 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 21.2 m-70 -63.26 103.01 0.45 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.486 -179.443 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.35 33.29 0.72 Allowed 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.078 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -174.52 178.48 1.95 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.005 -179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -146.19 54.1 1.14 Allowed 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 121.018 0.437 . . . . 0.0 110.883 179.558 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.226 -0.893 . . . . 0.0 110.767 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 120.813 0.339 . . . . 0.0 111.314 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 87.2 p -113.14 179.45 3.96 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.705 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.6 t70 63.88 94.55 0.05 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.98 0.419 . . . . 0.0 111.053 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.4 t -81.0 125.02 39.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.016 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.11 115.47 29.09 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.604 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.468 ' N ' HD12 ' A' ' 6' ' ' ILE . 3.8 mp -110.1 134.05 53.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.059 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.64 114.95 29.08 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.679 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.604 ' HB3' HD21 ' A' ' 79' ' ' LEU . 61.2 m-85 -103.2 127.03 50.64 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.775 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -120.33 124.05 44.61 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.916 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.8 t-160 -139.27 116.23 10.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.547 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.27 31.7 21.38 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.174 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.66 -28.79 9.42 Favored Glycine 0 C--N 1.339 0.695 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.867 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -65.03 137.4 57.68 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.796 0.331 . . . . 0.0 111.098 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -110.23 136.05 50.04 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.014 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.1 mtp180 -130.03 136.49 49.45 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.96 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.5 mp -114.38 117.4 55.46 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.873 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.407 HD12 ' CD2' ' A' ' 8' ' ' PHE . 19.9 mt -131.87 137.06 55.78 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 CA-C-O 120.828 0.347 . . . . 0.0 111.27 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -101.67 132.54 47.31 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.079 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.456 ' HD2' HD13 ' A' ' 6' ' ' ILE . 24.3 m-85 -124.96 126.48 45.54 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.977 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.1 m -72.78 153.89 40.9 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.375 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.5 mtt180 -95.48 146.98 32.27 Favored Pre-proline 0 CA--C 1.53 0.208 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.166 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -78.24 124.08 10.25 Favored 'Cis proline' 0 C--N 1.349 0.569 0 C-N-CA 123.313 -1.536 . . . . 0.0 112.49 -0.052 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.0 p -69.34 126.88 30.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.99 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.567 ' O ' HG23 ' A' ' 28' ' ' VAL . 23.1 mmmt -102.18 147.69 26.33 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.029 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.527 ' CZ ' HD12 ' A' ' 42' ' ' LEU . 33.4 t80 -60.42 -40.18 90.09 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.65 179.446 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -62.23 -44.71 95.94 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.246 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.85 -44.35 96.37 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.189 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.568 ' O ' HG23 ' A' ' 32' ' ' VAL . 35.9 t -65.86 -46.92 87.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.479 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -63.11 -42.15 99.5 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.266 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -56.2 -43.07 78.15 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.56 0.219 . . . . 0.0 111.471 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.687 ' O ' HG23 ' A' ' 35' ' ' VAL . 4.1 mttp -70.38 -49.7 46.36 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.183 179.794 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 28' ' ' VAL . 38.6 t -62.4 -40.98 90.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.463 -179.809 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.791 HG23 ' HB3' ' A' ' 38' ' ' GLN . 52.4 m -61.8 -43.02 99.68 Favored 'General case' 0 C--O 1.226 -0.182 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.194 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 40.1 m -72.44 -44.18 62.76 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 111.533 0.197 . . . . 0.0 111.533 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.687 HG23 ' O ' ' A' ' 31' ' ' LYS . 65.2 t -63.53 -48.43 86.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.229 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.44 ' HB2' ' CD1' ' A' ' 40' ' ' LEU . 68.7 m-85 -102.37 10.12 39.3 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -178.84 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.26 173.41 16.03 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.775 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.791 ' HB3' HG23 ' A' ' 33' ' ' THR . 0.0 OUTLIER -127.86 157.96 71.99 Favored Pre-proline 0 N--CA 1.464 0.229 0 O-C-N 122.814 -0.227 . . . . 0.0 110.763 179.93 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -89.34 153.3 30.54 Favored 'Cis proline' 0 C--N 1.35 0.611 0 C-N-CA 123.803 -1.332 . . . . 0.0 113.351 0.368 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.524 HD23 ' HA ' ' A' ' 81' ' ' SER . 51.9 mt -138.32 159.17 42.74 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.134 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -114.16 134.88 54.6 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.706 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.527 HD12 ' CZ ' ' A' ' 25' ' ' TYR . 50.7 mt -92.59 107.15 19.0 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.739 0.304 . . . . 0.0 110.834 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -113.78 129.58 56.56 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.279 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.562 ' HB2' HD11 ' A' ' 53' ' ' LEU . 14.8 t80 -108.27 124.3 50.11 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.477 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.0 ptm -126.18 130.83 51.77 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.855 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -89.92 -71.45 0.61 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.165 -179.525 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -142.13 -71.89 0.33 Allowed 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.553 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -117.53 16.73 14.61 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.128 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.1 mt -131.59 143.74 50.56 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.611 0.244 . . . . 0.0 110.924 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.67 126.61 54.69 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.93 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.403 HD13 ' CD1' ' A' ' 44' ' ' TYR . 3.8 mp -122.75 132.73 70.73 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.109 -179.758 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.1 tt -102.69 135.66 43.93 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.798 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.562 HD11 ' HB2' ' A' ' 44' ' ' TYR . 0.6 OUTLIER -109.13 110.22 21.41 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.914 -179.938 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.56 -36.14 9.28 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.23 179.724 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -129.72 174.06 10.05 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.07 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -56.61 -33.86 66.67 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.028 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -54.44 -46.06 73.17 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 123.277 0.36 . . . . 0.0 110.956 179.727 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -61.92 -43.9 97.88 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.804 179.506 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 22.9 tp -69.01 -37.95 78.98 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.377 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.541 ' HA ' HD12 ' A' ' 63' ' ' ILE . 1.2 t70 -61.74 -43.09 99.53 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.935 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.58 -33.72 75.59 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.971 179.466 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.552 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -62.55 -35.63 80.08 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.402 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.541 HD12 ' HA ' ' A' ' 60' ' ' ASP . 13.4 mt -65.93 -44.91 92.33 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 CA-C-O 120.642 0.258 . . . . 0.0 110.468 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -41.63 89.14 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.948 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.552 HD12 ' HA ' ' A' ' 62' ' ' ALA . 11.0 mt -67.6 -41.68 85.92 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.111 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.423 HD13 ' HG ' ' A' ' 75' ' ' LEU . 1.9 tp -59.98 -47.32 86.29 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.85 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -67.63 -36.74 81.36 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.79 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 -66.21 -27.54 68.06 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.577 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 32.6 t -58.77 147.43 33.36 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.93 0.395 . . . . 0.0 111.629 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.6 p -71.33 -31.1 66.99 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.35 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.4 t -144.28 85.85 1.81 Allowed 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.955 0.407 . . . . 0.0 110.862 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 6.6 ttt -171.07 100.87 0.21 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.09 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.13 -35.1 10.12 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.234 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.405 ' C ' HD21 ' A' ' 66' ' ' LEU . 0.4 OUTLIER -98.54 159.02 15.23 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.61 0.243 . . . . 0.0 110.771 179.735 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.423 ' HG ' HD13 ' A' ' 66' ' ' LEU . 0.1 OUTLIER -91.93 126.41 37.0 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.816 -179.979 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -86.48 86.43 7.34 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.772 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.412 HD11 ' CD2' ' A' ' 75' ' ' LEU . 30.5 mm -104.15 128.22 57.75 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.052 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -114.58 118.74 34.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.688 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.604 HD21 ' HB3' ' A' ' 8' ' ' PHE . 0.2 OUTLIER -108.18 131.9 54.18 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.456 179.773 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.1 pp -125.59 151.1 46.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.09 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.524 ' HA ' HD23 ' A' ' 40' ' ' LEU . 1.1 p -65.57 146.92 54.24 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.067 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -82.77 5.53 21.16 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -91.29 50.57 1.77 Allowed 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.004 0.431 . . . . 0.0 111.151 179.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.2 ttt85 -112.44 58.13 0.65 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.017 179.326 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -73.47 102.7 3.87 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.874 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.44 -49.13 2.38 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.99 -179.69 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -90.05 136.3 33.13 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.107 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -113.32 110.51 20.47 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.714 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 19.5 m170 -104.48 141.29 36.63 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.223 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -162.28 88.88 0.67 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.92 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -102.74 33.88 3.04 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.956 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 64.5 t-80 -152.95 96.12 2.05 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.473 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 1.2 t60 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.113 -0.946 . . . . 0.0 111.068 -179.756 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 120.555 0.217 . . . . 0.0 111.305 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.6 m 68.56 174.33 0.28 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.966 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 66.08 105.01 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.999 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.4 t -111.03 100.19 10.25 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.988 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.6 mtt180 -89.34 108.63 19.74 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.799 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.523 HG21 HD12 ' A' ' 77' ' ' ILE . 7.0 mt -106.46 134.59 47.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.216 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.9 mmtt -103.1 121.29 42.31 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.735 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -109.41 138.45 45.75 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.974 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.406 ' HG3' ' HG2' ' A' ' 14' ' ' ARG . 1.3 tt0 -119.28 126.0 50.43 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.18 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -138.04 121.0 16.59 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.608 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 59.09 31.63 21.47 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.26 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.2 -35.78 3.98 Favored Glycine 0 C--N 1.337 0.638 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.775 -179.529 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -66.99 146.35 54.47 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.871 0.367 . . . . 0.0 111.219 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.406 ' HG2' ' HG3' ' A' ' 9' ' ' GLU . 22.6 mtm105 -113.51 147.18 38.39 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.361 -179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.94 136.28 40.3 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.087 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.6 mp -116.74 118.26 58.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.906 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.6 mt -127.98 136.49 60.13 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-O 120.863 0.363 . . . . 0.0 111.313 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.6 143.83 26.36 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.249 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.584 ' CE2' HG22 ' A' ' 28' ' ' VAL . 16.3 m-85 -130.79 133.66 46.17 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.08 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.88 132.58 35.22 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.986 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.5 mtt180 -80.74 155.44 73.3 Favored Pre-proline 0 N--CA 1.464 0.226 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.087 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -72.75 124.68 9.44 Favored 'Cis proline' 0 C--N 1.349 0.579 0 C-N-CA 123.67 -1.388 . . . . 0.0 112.379 0.085 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.1 p -72.7 141.79 15.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.226 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.53 ' O ' HG23 ' A' ' 28' ' ' VAL . 11.0 mmtt -118.59 128.44 54.56 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.9 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -57.41 -36.59 71.52 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.78 179.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.26 -44.77 94.2 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.089 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -69.05 -44.36 72.8 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.124 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.705 ' O ' HG23 ' A' ' 32' ' ' VAL . 38.6 t -66.43 -47.47 83.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.151 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -61.47 -45.64 93.42 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.125 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -62.66 -45.2 93.91 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.723 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.751 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.4 OUTLIER -63.36 -49.34 74.26 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.408 179.921 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.705 HG23 ' O ' ' A' ' 28' ' ' VAL . 56.0 t -60.94 -42.65 93.65 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.377 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 92.1 m -61.98 -39.46 92.26 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.056 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.8 m -72.28 -41.4 66.73 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 111.6 0.222 . . . . 0.0 111.6 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.751 HG23 ' O ' ' A' ' 31' ' ' LYS . 50.7 t -60.0 -52.49 60.57 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-O 120.575 0.226 . . . . 0.0 111.545 -179.402 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -88.42 -23.24 23.37 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -179.047 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.499 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 104.25 -176.08 23.26 Favored Glycine 0 CA--C 1.523 0.588 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.371 -179.599 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -137.35 156.79 75.02 Favored Pre-proline 0 N--CA 1.466 0.349 0 CA-C-O 120.624 0.249 . . . . 0.0 111.134 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -85.85 140.17 26.64 Favored 'Cis proline' 0 C--N 1.349 0.574 0 C-N-CA 123.451 -1.479 . . . . 0.0 112.979 0.075 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.499 HD12 ' O ' ' A' ' 37' ' ' GLY . 21.8 mt -137.73 139.14 39.97 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.947 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -106.65 136.88 45.69 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.163 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 66.7 mt -86.54 108.74 18.7 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.048 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -112.23 119.96 40.13 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.899 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.402 ' HB3' ' CD2' ' A' ' 53' ' ' LEU . 10.3 t80 -106.33 130.06 54.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.562 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.1 ppp? -130.6 122.81 28.15 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.953 0.406 . . . . 0.0 110.937 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -79.12 -41.43 28.6 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.529 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -170.24 -67.18 0.02 OUTLIER 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.553 179.432 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -111.44 -24.64 10.05 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.634 179.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.457 HD13 ' N ' ' A' ' 50' ' ' SER . 0.2 OUTLIER -105.74 138.77 41.38 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.656 0.265 . . . . 0.0 111.328 -179.563 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.457 ' N ' HD13 ' A' ' 49' ' ' LEU . 17.0 t -110.09 131.06 55.39 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.711 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.3 mt -113.56 134.16 57.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.604 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.0 mt -84.47 118.04 24.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.034 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.562 HD13 ' CB ' ' A' ' 58' ' ' ASP . 3.4 mm? -86.33 100.0 11.99 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.312 179.513 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.6 mttt -135.22 25.22 3.53 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.932 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -173.5 157.18 3.17 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.653 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -61.09 -32.33 72.0 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.654 179.511 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.75 -45.82 81.77 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.888 179.777 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.562 ' CB ' HD13 ' A' ' 53' ' ' LEU . 8.1 m-20 -60.47 -42.29 95.95 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.814 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 13.6 tp -66.71 -42.6 86.12 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.804 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.896 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.2 OUTLIER -62.73 -38.88 92.23 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.379 179.977 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -39.93 95.67 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.804 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.99 -36.33 83.18 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.096 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.896 HD12 ' HA ' ' A' ' 60' ' ' ASP . 14.4 mt -65.18 -44.22 95.38 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.139 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.826 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -55.44 -45.78 76.77 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.082 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 10.7 mt -67.19 -40.44 85.15 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.607 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.491 HD21 ' O ' ' A' ' 73' ' ' LYS . 0.5 OUTLIER -64.0 -44.1 93.68 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.002 179.598 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -57.2 -34.58 68.65 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.183 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.2 mtp85 -73.66 -31.36 63.44 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.474 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.8 t -96.36 101.03 12.6 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.367 -179.682 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.7 t -59.74 -38.44 81.74 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.18 179.574 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 56.3 p -59.12 -36.12 74.63 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.236 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.34 149.36 30.3 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.065 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.491 ' O ' HD21 ' A' ' 66' ' ' LEU . 22.3 mttp -144.0 -47.23 0.27 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.148 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 95.4 p -101.89 167.65 9.93 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.95 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.1 mt -104.91 130.7 53.02 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.049 -179.834 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.33 81.26 8.43 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.938 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.523 HD12 HG21 ' A' ' 6' ' ' ILE . 24.3 mt -102.69 116.78 47.02 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.685 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 46.3 mt -101.95 117.34 34.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.614 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.419 HD13 HD13 ' A' ' 40' ' ' LEU . 1.8 pp -101.92 131.85 48.06 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.902 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.2 mp -129.35 155.12 46.14 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.027 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.468 ' HA ' HD23 ' A' ' 40' ' ' LEU . 0.4 OUTLIER -65.75 146.31 54.93 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.913 179.864 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.65 5.39 21.27 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.266 -0.425 . . . . 0.0 112.093 179.832 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -108.33 88.22 2.68 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.843 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 26.6 mtm-85 -100.57 35.46 2.14 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.316 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -133.21 56.4 1.85 Allowed 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.895 0.379 . . . . 0.0 111.26 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.1 tp -152.12 31.01 0.55 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.33 179.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -168.38 39.27 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 120.79 0.329 . . . . 0.0 111.48 179.731 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -80.28 125.45 29.89 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.847 0.356 . . . . 0.0 111.496 -179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 33.2 p80 -107.02 134.75 49.7 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.971 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 28.1 m80 61.36 177.65 0.11 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.49 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 33.4 m80 -144.85 -50.66 0.27 Allowed 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.189 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -134.68 28.3 3.61 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.742 0.306 . . . . 0.0 111.327 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 3.3 t60 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 117.796 -1.097 . . . . 0.0 111.018 -179.879 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 120.47 0.176 . . . . 0.0 111.125 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 m 68.69 164.4 0.24 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.072 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 57.34 93.26 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.308 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.2 t -108.56 128.59 64.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.447 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.6 mtt180 -89.88 113.23 24.8 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.796 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.506 ' CG2' HD12 ' A' ' 77' ' ' ILE . 3.0 mt -103.34 133.83 46.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.145 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -94.13 128.54 40.6 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.757 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.508 ' HB3' HD21 ' A' ' 79' ' ' LEU . 96.8 m-85 -116.96 132.23 56.75 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.909 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.404 ' HA ' ' O ' ' A' ' 13' ' ' GLU . 1.8 mt-10 -119.09 123.46 44.5 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.04 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 -129.35 118.0 21.53 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.734 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 57.92 33.68 23.47 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.472 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.67 -29.08 9.57 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.989 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.404 ' O ' ' HA ' ' A' ' 9' ' ' GLU . 17.7 tt0 -64.79 148.3 51.51 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.707 0.289 . . . . 0.0 111.131 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.2 mtp180 -120.35 134.55 55.24 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.136 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 50.8 mtp180 -142.99 149.61 38.54 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.305 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.0 mt -114.46 133.76 59.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.242 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 23.8 mt -137.58 130.76 42.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.209 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.78 141.34 28.55 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.199 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -137.48 132.42 33.28 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.132 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.5 m -84.55 125.41 32.39 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.869 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 54.9 mtm180 -89.44 154.67 48.78 Favored Pre-proline 0 CA--C 1.529 0.155 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.116 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -74.61 121.07 6.98 Favored 'Cis proline' 0 C--N 1.351 0.663 0 C-N-CA 123.725 -1.365 . . . . 0.0 112.506 0.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.8 p -101.77 131.36 49.84 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.8 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp -78.28 144.56 36.03 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.825 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.514 ' CD1' HD13 ' A' ' 59' ' ' LEU . 50.8 t80 -56.77 -39.56 74.28 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.79 179.426 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.417 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -62.9 -36.01 81.95 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.15 179.696 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -67.92 -44.1 77.65 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 116.697 -0.228 . . . . 0.0 110.98 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.469 ' O ' HG23 ' A' ' 32' ' ' VAL . 31.6 t -63.84 -47.33 91.26 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.956 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.417 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 13.0 pt-20 -66.75 -35.08 79.27 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.085 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -56.43 -45.39 80.77 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.628 0.251 . . . . 0.0 110.852 179.531 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.662 ' O ' HG23 ' A' ' 35' ' ' VAL . 5.4 mmmt -68.25 -49.26 61.82 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.91 179.66 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 28' ' ' VAL . 40.1 t -61.25 -40.67 86.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.477 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.501 HG23 ' HB3' ' A' ' 38' ' ' GLN . 98.1 m -66.45 -41.72 88.67 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.069 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.3 m -72.63 -43.53 63.11 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 111.68 0.252 . . . . 0.0 111.68 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.662 HG23 ' O ' ' A' ' 31' ' ' LYS . 60.7 t -66.28 -44.06 91.33 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -179.304 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.535 ' HB2' HD11 ' A' ' 40' ' ' LEU . 18.0 m-85 -103.46 10.88 37.03 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -179.081 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.02 171.16 10.76 Favored Glycine 0 C--N 1.338 0.673 0 C-N-CA 120.736 -0.745 . . . . 0.0 113.057 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.501 ' HB3' HG23 ' A' ' 33' ' ' THR . 2.2 pt20 -120.29 159.19 48.65 Favored Pre-proline 0 N--CA 1.466 0.337 0 O-C-N 122.821 -0.223 . . . . 0.0 110.785 179.565 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -89.05 153.69 32.31 Favored 'Cis proline' 0 C--N 1.351 0.662 0 C-N-CA 123.846 -1.314 . . . . 0.0 113.477 0.459 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.535 HD11 ' HB2' ' A' ' 36' ' ' PHE . 48.3 mt -138.19 133.17 32.92 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.977 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.443 ' OD1' HD11 ' A' ' 52' ' ' LEU . 1.6 t0 -105.77 134.78 48.34 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.808 179.507 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.2 102.71 14.75 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.146 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.426 ' HA ' HD12 ' A' ' 52' ' ' LEU . 0.8 OUTLIER -101.5 122.12 43.22 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.229 -179.723 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.754 ' HB2' HD11 ' A' ' 53' ' ' LEU . 10.9 t80 -103.78 130.52 51.32 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.725 179.581 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 8.3 mtt -117.22 124.12 48.3 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.623 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -84.92 -61.92 1.66 Allowed 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.225 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -164.12 -64.12 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.694 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -112.83 -13.38 13.19 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.524 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.7 tp -120.44 143.76 48.32 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-O 120.69 0.281 . . . . 0.0 111.319 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.4 m -100.89 124.71 46.98 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.751 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.4 mt -118.59 133.51 65.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.001 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.589 HD23 ' HE2' ' A' ' 54' ' ' LYS . 14.1 tp -103.38 134.5 46.65 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.84 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.754 HD11 ' HB2' ' A' ' 44' ' ' TYR . 3.6 mp -84.89 84.31 7.75 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.751 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.589 ' HE2' HD23 ' A' ' 52' ' ' LEU . 67.5 mttm -90.28 -35.11 15.47 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.207 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -120.86 159.65 25.06 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.914 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.5 tm0? -60.16 -33.75 72.61 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.962 179.72 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.57 -40.61 79.32 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.093 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.67 -42.72 97.63 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.778 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.528 HD12 ' CD2' ' A' ' 53' ' ' LEU . 3.8 tp -68.46 -40.06 81.18 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.953 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.424 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.8 OUTLIER -61.33 -43.38 98.96 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.075 179.913 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.68 -35.74 79.39 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.85 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.64 -40.21 96.31 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.542 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.424 HD12 ' HA ' ' A' ' 60' ' ' ASP . 13.8 mt -64.16 -41.17 91.59 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 116.732 -0.213 . . . . 0.0 111.008 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -54.84 -40.13 69.29 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.028 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 44.4 mt -67.85 -42.01 85.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.811 179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.4 tp -65.54 -45.88 81.73 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.729 179.518 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.56 -39.63 77.12 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.105 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.1 mmt-85 -61.93 -34.37 75.96 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.213 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 42.5 t -84.8 105.26 15.45 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.907 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 85.6 p -67.59 -32.16 72.72 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.017 179.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.2 t -67.32 -43.14 82.35 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.953 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.42 120.98 25.68 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.103 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.46 -40.09 4.74 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.185 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 53.6 p -91.6 167.51 12.16 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.66 -0.246 . . . . 0.0 111.111 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.453 HD22 HD11 ' A' ' 77' ' ' ILE . 0.2 OUTLIER -107.57 131.12 54.69 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.23 -179.966 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -91.41 86.8 6.2 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.69 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.506 HD12 ' CG2' ' A' ' 6' ' ' ILE . 29.4 mt -117.95 129.3 74.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.004 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.99 117.58 32.44 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.836 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.508 HD21 ' HB3' ' A' ' 8' ' ' PHE . 0.5 OUTLIER -99.0 131.04 45.34 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.97 179.962 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 pp -122.93 130.57 53.0 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.705 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.421 ' HA ' HD23 ' A' ' 40' ' ' LEU . 39.4 t -75.99 135.7 40.0 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.767 179.734 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 34.8 tp60 -87.83 6.19 36.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.989 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -59.48 89.26 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.258 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.2 ttp85 -122.14 -49.47 2.06 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.59 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 68.88 111.01 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.519 179.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.468 ' HB3' ' CE1' ' A' ' 90' ' ' HIS . 6.2 tp -81.2 160.47 24.32 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.538 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -110.94 -54.86 2.56 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.299 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -104.96 157.16 17.41 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.805 0.336 . . . . 0.0 111.294 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.06 89.5 0.09 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.291 179.701 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.468 ' CE1' ' HB3' ' A' ' 86' ' ' LEU . 0.0 OUTLIER -146.43 -49.46 0.2 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.996 179.938 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 14.4 p80 -99.51 162.57 12.95 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.372 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -100.2 153.73 19.03 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.339 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.251 1.138 0 CA-C-O 118.587 -0.72 . . . . 0.0 111.226 179.676 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 . . . . . 0 N--CA 1.49 1.526 0 CA-C-O 120.689 0.28 . . . . 0.0 111.139 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.7 m 57.09 40.13 28.64 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.987 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -158.36 76.89 0.77 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.498 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 38.2 t -77.68 128.89 37.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.584 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 23.2 mtm180 -93.14 115.59 28.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.805 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.564 HD12 ' CD1' ' A' ' 19' ' ' PHE . 24.7 mt -108.31 128.68 63.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.856 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 39.4 mttt -106.23 126.99 52.9 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.009 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.416 ' HD1' HD23 ' A' ' 79' ' ' LEU . 89.2 m-85 -114.43 143.28 45.17 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.083 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -128.02 127.99 44.18 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.997 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.0 t-160 -143.1 118.88 10.51 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.602 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 58.4 37.29 25.79 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.345 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 91.57 -47.14 2.78 Favored Glycine 0 C--N 1.334 0.437 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.719 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.49 141.14 52.0 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.733 0.301 . . . . 0.0 110.92 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -125.06 149.75 47.49 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.323 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.51 139.46 50.5 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.948 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.4 mp -99.73 133.23 43.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.954 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 9.1 tp -129.46 137.58 56.51 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.395 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.87 131.38 35.83 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.994 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.745 ' CE2' HG22 ' A' ' 28' ' ' VAL . 6.6 m-85 -132.34 125.81 31.77 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.228 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.4 m -98.86 142.84 29.87 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.882 179.617 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 68.4 mtt180 -74.02 151.15 88.32 Favored Pre-proline 0 N--CA 1.464 0.245 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.948 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.75 125.87 12.47 Favored 'Cis proline' 0 C--N 1.352 0.715 0 C-N-CA 123.474 -1.469 . . . . 0.0 112.658 0.035 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.468 ' O ' HG13 ' A' ' 23' ' ' VAL . 11.9 p -89.61 114.94 28.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.077 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.592 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -99.66 137.16 38.53 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.106 -179.55 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.438 ' HD1' HD22 ' A' ' 59' ' ' LEU . 72.7 t80 -56.47 -40.31 74.64 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.141 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -63.57 -44.75 93.17 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.101 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -66.36 -44.28 83.62 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.374 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.745 HG22 ' CE2' ' A' ' 19' ' ' PHE . 43.1 t -65.35 -47.66 86.19 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.721 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -59.89 -42.66 94.31 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.095 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.82 -42.4 79.53 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.056 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.791 ' O ' HG23 ' A' ' 35' ' ' VAL . 13.9 mtpt -69.49 -49.63 52.92 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.028 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.547 HG23 ' O ' ' A' ' 28' ' ' VAL . 34.9 t -61.3 -40.55 86.49 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.441 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.498 HG23 ' HB3' ' A' ' 38' ' ' GLN . 88.5 m -59.3 -41.73 89.69 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.844 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 48.7 m -72.13 -31.76 66.3 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 111.464 0.172 . . . . 0.0 111.464 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 31' ' ' LYS . 48.1 t -63.95 -55.88 19.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 111.632 0.234 . . . . 0.0 111.632 -179.6 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.63 ' HB2' HD11 ' A' ' 40' ' ' LEU . 77.7 m-85 -97.56 -10.66 24.8 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 -178.793 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.97 -172.41 24.55 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.475 -179.551 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.498 ' HB3' HG23 ' A' ' 33' ' ' THR . 1.4 pt20 -143.65 156.81 59.6 Favored Pre-proline 0 N--CA 1.465 0.277 0 O-C-N 122.83 -0.218 . . . . 0.0 111.338 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -81.44 153.31 80.08 Favored 'Cis proline' 0 C--N 1.35 0.636 0 C-N-CA 123.803 -1.332 . . . . 0.0 112.884 0.234 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.63 HD11 ' HB2' ' A' ' 36' ' ' PHE . 48.0 mt -136.01 149.08 48.69 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.029 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -116.0 120.23 38.47 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.793 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.434 HD12 ' OH ' ' A' ' 25' ' ' TYR . 73.2 mt -81.95 97.29 8.01 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.727 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -97.9 113.71 25.61 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.286 -179.562 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.752 ' HB2' HD11 ' A' ' 53' ' ' LEU . 14.1 t80 -98.85 123.56 43.19 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.717 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.4 mtt -126.23 131.86 51.85 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.673 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -76.91 -43.92 33.73 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.631 179.704 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -173.93 -49.85 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.605 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -119.34 -36.58 3.33 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.375 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.8 mp -95.26 134.14 38.36 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.827 0.346 . . . . 0.0 111.24 -179.553 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 98.1 p -105.04 121.2 43.29 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.844 179.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.4 mt -114.75 132.49 63.77 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.86 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.546 HD23 ' N ' ' A' ' 53' ' ' LEU . 4.9 tt -88.26 132.91 34.2 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.658 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.752 HD11 ' HB2' ' A' ' 44' ' ' TYR . 2.4 mt -103.01 94.67 5.67 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.69 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.532 ' HD2' HD22 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -110.07 27.66 9.38 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.486 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -173.45 164.92 4.65 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.919 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.42 -37.15 86.53 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.548 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -58.51 -40.9 84.16 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.653 -0.249 . . . . 0.0 110.909 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.551 ' HB3' HD23 ' A' ' 53' ' ' LEU . 20.3 m-20 -65.79 -43.79 87.67 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.781 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.579 HD12 HD13 ' A' ' 53' ' ' LEU . 7.2 tp -67.21 -41.76 85.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.802 179.401 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.593 ' HA ' HD12 ' A' ' 63' ' ' ILE . 5.4 t70 -63.85 -43.1 97.16 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.932 179.706 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.4 tttm -63.87 -32.13 73.54 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.411 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.77 -40.38 97.09 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.389 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.593 HD12 ' HA ' ' A' ' 60' ' ' ASP . 5.0 mt -64.42 -40.92 90.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.935 179.642 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -55.32 -34.95 64.62 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.001 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 41.7 mt -65.96 -40.92 88.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.085 179.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.593 HD22 HD21 ' A' ' 75' ' ' LEU . 12.4 tp -65.33 -45.02 85.93 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.768 179.578 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -56.97 -39.42 74.57 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.608 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -65.05 -32.76 74.64 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.203 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.5 t -70.04 146.5 50.95 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.809 0.338 . . . . 0.0 111.278 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 2.3 m -76.3 -34.82 59.06 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.426 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.3 p -77.79 -52.23 9.24 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.285 -179.476 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 13.9 ptt? 40.56 86.46 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.547 0 O-C-N 123.484 0.49 . . . . 0.0 112.223 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.09 82.78 2.07 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.961 0.41 . . . . 0.0 111.173 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.562 ' C ' HD22 ' A' ' 75' ' ' LEU . 0.4 OUTLIER 63.28 -179.37 0.15 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.44 179.856 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.593 HD21 HD22 ' A' ' 66' ' ' LEU . 3.5 mm? -122.31 122.47 39.15 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.077 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.3 mtt180 -83.4 93.81 7.84 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.004 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.3 mt -109.06 128.09 65.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.869 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.5 mp -103.64 126.45 50.79 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.192 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.416 HD23 ' HD1' ' A' ' 8' ' ' PHE . 3.8 pp -111.13 136.22 50.5 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.786 0.327 . . . . 0.0 111.169 179.706 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.1 mp -128.95 155.38 45.42 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.976 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.63 ' HA ' HD23 ' A' ' 40' ' ' LEU . 0.9 OUTLIER -85.9 141.44 29.57 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.162 179.916 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -87.85 5.66 39.23 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.995 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -145.26 76.54 1.49 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.531 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -112.05 24.09 13.02 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.638 -179.725 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -146.86 105.31 3.8 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.637 0.256 . . . . 0.0 111.09 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.417 ' O ' HD12 ' A' ' 86' ' ' LEU . 2.3 pp -89.29 115.83 27.06 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.809 0.337 . . . . 0.0 110.914 179.586 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -127.04 103.98 7.74 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.701 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -111.73 -174.89 2.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.884 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 4.4 t-160 -92.38 37.94 1.0 Allowed 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.326 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -100.79 74.07 1.62 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.953 0.406 . . . . 0.0 110.386 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 81.9 m-70 -65.13 156.12 32.66 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.198 -179.575 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 9.7 p-80 -99.47 108.84 21.39 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.806 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 17.3 p80 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.054 -0.974 . . . . 0.0 111.35 -179.758 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 120.597 0.237 . . . . 0.0 111.418 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.6 t -149.86 147.53 28.06 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.988 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 60.78 92.43 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.064 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.8 t -84.27 124.42 39.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.033 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.447 ' HG3' ' HB2' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -92.36 117.44 29.91 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.858 179.89 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.401 ' CG2' HD12 ' A' ' 77' ' ' ILE . 2.3 mt -103.64 130.42 54.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.12 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 tmtt? -110.55 114.42 27.82 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.711 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 12.2 p90 -113.34 146.96 38.58 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.079 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -124.48 143.95 50.37 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.106 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -140.39 111.84 7.3 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.678 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 54.58 34.49 21.4 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.645 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 104.75 -42.48 1.89 Allowed Glycine 0 C--N 1.334 0.459 0 C-N-CA 120.921 -0.657 . . . . 0.0 112.741 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.55 135.46 56.02 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.689 0.28 . . . . 0.0 111.076 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -115.05 154.08 29.52 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.596 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -151.79 136.37 16.98 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.157 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.42 ' O ' HD13 ' A' ' 17' ' ' ILE . 25.7 mt -114.38 126.56 71.94 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.135 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.42 HD13 ' O ' ' A' ' 16' ' ' ILE . 26.2 mm -130.63 131.13 64.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.12 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.447 ' HB2' ' HG3' ' A' ' 5' ' ' ARG . . . -95.66 134.05 39.01 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.13 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.44 ' CE2' HG13 ' A' ' 28' ' ' VAL . 9.5 m-85 -126.94 124.19 38.92 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.201 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -80.87 150.26 29.15 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.052 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.499 ' HD2' HG12 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -91.42 152.01 43.26 Favored Pre-proline 0 CA--C 1.532 0.274 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.256 179.995 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -76.04 131.3 23.82 Favored 'Cis proline' 0 C--N 1.35 0.629 0 C-N-CA 123.233 -1.57 . . . . 0.0 112.318 -0.06 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.499 HG12 ' HD2' ' A' ' 21' ' ' ARG . 14.9 p -119.96 123.55 71.04 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.043 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.443 ' O ' HG23 ' A' ' 28' ' ' VAL . 39.7 mttp -91.79 151.09 20.76 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.08 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -62.65 -35.99 81.42 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.895 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -63.37 -44.66 94.14 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.987 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.67 -44.4 93.88 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.392 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 24' ' ' LYS . 39.4 t -67.73 -47.62 79.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 120.777 0.322 . . . . 0.0 110.685 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -63.42 -44.5 94.42 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.36 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -56.33 -39.04 72.17 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.471 -179.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.791 ' O ' HG23 ' A' ' 35' ' ' VAL . 6.7 tttt -64.13 -47.58 79.39 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-O 120.64 0.257 . . . . 0.0 110.556 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 28' ' ' VAL . 20.7 t -63.52 -40.25 88.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.691 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.641 HG22 ' HG3' ' A' ' 38' ' ' GLN . 0.1 OUTLIER -59.28 -40.69 86.91 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 116.856 -0.156 . . . . 0.0 111.112 -179.932 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.9 m -72.47 -33.25 66.87 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.436 0.16 . . . . 0.0 111.088 179.29 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 31' ' ' LYS . 44.7 t -68.03 -53.1 32.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.485 ' HB2' HD11 ' A' ' 40' ' ' LEU . 30.6 m-85 -99.85 9.12 43.52 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -179.124 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.86 176.46 26.41 Favored Glycine 0 C--N 1.335 0.524 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.877 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.641 ' HG3' HG22 ' A' ' 33' ' ' THR . 1.3 mt-30 -124.35 158.54 60.95 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-O 120.467 0.175 . . . . 0.0 110.944 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -90.07 153.51 27.53 Favored 'Cis proline' 0 C--N 1.348 0.526 0 C-N-CA 123.901 -1.291 . . . . 0.0 113.175 0.442 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.578 HD23 ' HA ' ' A' ' 81' ' ' SER . 78.1 mt -138.54 148.35 44.14 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.942 179.573 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -115.16 123.58 49.28 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.663 179.412 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.548 HD23 ' HB3' ' A' ' 79' ' ' LEU . 81.1 mt -88.32 102.01 14.44 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.182 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -96.59 122.01 39.05 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.024 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.647 ' CZ ' ' HB1' ' A' ' 62' ' ' ALA . 15.2 t80 -104.3 119.04 38.07 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.47 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 27.6 mmm -94.32 130.97 40.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.768 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -82.5 -50.39 8.89 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.874 0.369 . . . . 0.0 110.348 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -172.41 -63.51 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.009 179.613 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -107.14 -28.95 9.65 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.485 179.628 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.6 mt -109.12 162.98 13.75 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.919 0.39 . . . . 0.0 111.525 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.24 125.39 53.04 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.186 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.6 mm -116.61 132.7 65.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.944 179.775 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.495 HD12 ' O ' ' A' ' 42' ' ' LEU . 37.6 tp -94.75 126.55 40.14 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.841 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.444 HD21 ' CB ' ' A' ' 44' ' ' TYR . 15.6 mt -79.93 131.67 35.88 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.727 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.4 mmtt -108.04 -38.39 5.8 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.393 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 39.3 p30 -152.78 -172.3 4.2 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.041 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -55.98 -36.35 67.77 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.974 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.73 -44.99 70.35 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.859 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.64 -35.38 80.63 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.871 179.446 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.5 tp -72.91 -38.37 66.92 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.145 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -62.28 -43.38 98.96 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.263 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.3 ptpt -69.23 -30.77 68.99 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.808 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.647 ' HB1' ' CZ ' ' A' ' 44' ' ' TYR . . . -63.24 -39.4 94.49 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.294 179.751 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 21.6 mt -62.95 -40.89 90.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.838 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -55.82 -38.42 69.98 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.082 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 31.9 mm -68.77 -38.02 78.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.96 179.557 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.3 tp -62.28 -36.95 83.67 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.027 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.425 ' HA ' ' HG3' ' A' ' 72' ' ' MET . 14.6 t70 -57.9 -36.89 73.06 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.956 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 9.2 mtt-85 -65.74 -32.38 73.9 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.833 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 26.2 t -68.66 165.06 20.16 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.147 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.95 -37.73 38.85 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.861 -179.72 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.82 -69.75 0.27 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.649 -0.251 . . . . 0.0 111.483 -179.295 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.425 ' HG3' ' HA ' ' A' ' 67' ' ' ASP . 2.0 ttm 53.83 30.49 11.47 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 120.759 0.314 . . . . 0.0 111.422 -179.711 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.7 mmpt? -117.8 -31.25 5.19 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.687 -0.233 . . . . 0.0 111.28 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.2 p -126.53 165.57 18.88 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.928 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.505 HD12 ' HE2' ' A' ' 44' ' ' TYR . 2.7 mm? -113.5 122.25 46.7 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.626 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.2 mtt-85 -82.95 93.62 7.57 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 120.837 0.351 . . . . 0.0 110.762 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.401 HD12 ' CG2' ' A' ' 6' ' ' ILE . 17.2 mt -126.11 131.43 71.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.133 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.8 tp -115.27 117.04 29.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.522 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.548 ' HB3' HD23 ' A' ' 42' ' ' LEU . 3.8 pp -110.57 135.41 51.25 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.768 0.318 . . . . 0.0 110.952 179.765 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.1 mt -135.74 154.14 51.34 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.677 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.578 ' HA ' HD23 ' A' ' 40' ' ' LEU . 6.2 t -89.67 145.07 25.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.984 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -88.23 6.0 38.9 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.42 ' O ' ' HB2' ' A' ' 84' ' ' ARG . 12.2 p30 -65.8 97.29 0.33 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.929 0.395 . . . . 0.0 111.632 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.42 ' HB2' ' O ' ' A' ' 83' ' ' ASP . 9.8 mmt85 69.4 117.44 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 122.889 0.475 . . . . 0.0 111.883 179.63 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -139.07 97.2 3.25 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.731 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -76.4 121.92 23.75 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.376 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -85.74 -71.9 0.51 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.393 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 17.1 p-80 -139.43 129.42 25.0 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.859 0.361 . . . . 0.0 110.998 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 15.6 p80 -99.37 -16.25 18.49 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.936 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.1 m80 66.32 164.08 0.18 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.64 0.257 . . . . 0.0 111.192 -179.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 2.4 t60 66.22 105.45 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.112 -179.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -141.83 151.96 43.24 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.19 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 9.6 p80 . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.134 -0.936 . . . . 0.0 111.081 179.801 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 . . . . . 0 N--CA 1.49 1.543 0 CA-C-O 120.665 0.269 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.3 m 63.51 167.69 0.14 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.314 -179.639 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 59.1 99.74 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.184 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.412 HG23 ' HG3' ' A' ' 21' ' ' ARG . 19.2 t -108.56 123.7 64.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.334 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.91 106.62 18.52 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.594 179.687 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 23.0 mt -107.09 124.69 63.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.123 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.413 ' HG2' ' HA ' ' A' ' 76' ' ' ARG . 0.0 OUTLIER -101.6 116.98 33.96 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.764 179.544 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.61 ' CD1' HD23 ' A' ' 79' ' ' LEU . 20.5 m-85 -104.27 139.92 38.59 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.943 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.528 ' HB3' HD12 ' A' ' 78' ' ' LEU . 1.0 OUTLIER -123.37 132.25 53.91 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.95 -179.991 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -142.12 117.05 9.92 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.786 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 57.97 35.62 25.44 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.335 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.06 -35.46 4.17 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.839 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -64.8 135.99 56.4 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.737 0.268 . . . . 0.0 110.932 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -117.35 140.18 49.9 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.22 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 25.1 mtt-85 -148.25 136.4 21.16 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.234 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.5 mt -105.14 125.04 60.24 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.233 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 26.0 mm -115.78 133.08 63.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.104 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.4 132.16 37.91 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.104 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -128.01 146.03 50.79 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.196 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.52 141.73 28.41 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.998 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.412 ' HG3' HG23 ' A' ' 4' ' ' VAL . 12.8 mtm180 -98.2 138.6 20.9 Favored Pre-proline 0 C--O 1.233 0.192 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.017 179.686 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -75.14 146.93 87.8 Favored 'Cis proline' 0 C--N 1.35 0.615 0 C-N-CA 123.773 -1.345 . . . . 0.0 112.446 0.061 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.415 ' O ' HG13 ' A' ' 23' ' ' VAL . 12.4 p -117.56 121.03 66.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 120.918 0.39 . . . . 0.0 111.008 179.788 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.423 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -75.58 130.62 39.1 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.875 -179.97 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.41 ' OH ' HD13 ' A' ' 42' ' ' LEU . 74.9 t80 -55.31 -35.76 65.48 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.983 179.501 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -60.72 -42.37 97.14 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.879 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -67.91 -43.12 79.96 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.919 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.663 ' O ' HG23 ' A' ' 32' ' ' VAL . 21.2 t -61.96 -47.02 95.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.95 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.443 ' HG3' ' N ' ' A' ' 30' ' ' HIS . 10.5 pt-20 -65.72 -42.27 91.26 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.927 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.443 ' N ' ' HG3' ' A' ' 29' ' ' GLU . 0.8 OUTLIER -56.47 -42.48 78.3 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.233 -179.971 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.823 ' O ' HG23 ' A' ' 35' ' ' VAL . 11.9 tttt -70.25 -49.16 52.72 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.051 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.663 HG23 ' O ' ' A' ' 28' ' ' VAL . 24.4 t -63.19 -40.75 90.22 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.388 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.724 HG23 ' HB3' ' A' ' 38' ' ' GLN . 60.3 m -58.56 -42.56 88.23 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.057 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.1 m -72.31 -35.29 68.61 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 120.484 0.183 . . . . 0.0 111.452 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.823 HG23 ' O ' ' A' ' 31' ' ' LYS . 49.1 t -67.69 -50.71 58.13 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -179.5 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.409 ' HB2' ' CD1' ' A' ' 40' ' ' LEU . 18.4 m-85 -103.97 10.92 36.01 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -179.05 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.63 172.4 9.39 Favored Glycine 0 CA--C 1.523 0.545 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.906 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.724 ' HB3' HG23 ' A' ' 33' ' ' THR . 5.1 pt20 -128.63 158.82 70.81 Favored Pre-proline 0 N--CA 1.463 0.213 0 CA-C-O 120.457 0.17 . . . . 0.0 110.709 179.571 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -87.57 153.88 41.46 Favored 'Cis proline' 0 C--N 1.35 0.638 0 C-N-CA 123.834 -1.319 . . . . 0.0 113.441 0.555 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.538 HD13 HD13 ' A' ' 79' ' ' LEU . 47.6 mt -138.93 155.69 47.84 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.703 179.637 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -114.54 134.12 55.27 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.842 0.353 . . . . 0.0 110.83 179.223 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.41 HD13 ' OH ' ' A' ' 25' ' ' TYR . 5.4 mp -91.39 103.75 16.35 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.943 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.413 ' CD2' ' HB2' ' A' ' 50' ' ' SER . 0.1 OUTLIER -111.15 122.18 47.22 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.337 -179.552 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.772 ' HB3' HD11 ' A' ' 53' ' ' LEU . 13.4 t80 -124.32 130.52 52.66 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.699 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.43 133.14 49.97 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.799 179.473 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -63.74 -56.23 17.21 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.735 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -157.43 -53.94 0.07 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.583 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -127.04 7.79 6.64 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.522 179.459 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.2 mt -131.39 138.65 49.21 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.474 0.178 . . . . 0.0 110.895 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.413 ' HB2' ' CD2' ' A' ' 43' ' ' HIS . 29.9 p -110.33 131.62 54.89 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.964 179.718 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 24.4 mt -130.28 134.62 62.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.974 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.8 133.55 33.98 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.925 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.772 HD11 ' HB3' ' A' ' 44' ' ' TYR . 0.2 OUTLIER -126.26 87.98 2.76 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.773 179.916 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -109.12 26.72 10.3 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.988 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -154.7 154.16 32.44 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.774 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.0 tp60 -60.55 -34.03 73.55 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.853 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -59.7 -50.63 73.12 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.02 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.05 -42.91 99.68 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.841 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 15.1 tp -60.93 -40.75 94.4 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.01 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.578 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.3 OUTLIER -61.63 -41.53 97.61 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.908 179.744 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 15.6 mtpt -63.5 -36.84 85.08 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.77 -36.45 83.13 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.106 179.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.578 HD12 ' HA ' ' A' ' 60' ' ' ASP . 39.3 mt -60.16 -44.01 94.33 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.962 179.82 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -54.4 -41.31 69.13 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.967 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 46.2 mt -65.18 -46.21 91.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.019 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.1 mt -63.06 -39.35 94.47 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.914 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -57.99 -37.33 74.05 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.11 179.52 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.3 mmt180 -62.25 -35.13 78.01 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.206 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 33.1 t -88.76 112.19 22.89 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.123 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.2 m -72.6 -33.72 66.91 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.898 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.7 p -74.82 -37.08 62.4 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.491 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -90.37 111.92 23.33 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.085 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.6 pttt -126.41 32.17 5.24 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.932 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 61.4 p -146.64 153.64 40.54 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.121 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.5 mp -104.07 116.76 32.81 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.12 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.413 ' HA ' ' HG2' ' A' ' 7' ' ' LYS . 6.4 ttm180 -90.17 91.86 8.71 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.698 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.8 mt -110.31 122.75 65.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.004 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.528 HD12 ' HB3' ' A' ' 9' ' ' GLU . 0.8 OUTLIER -105.83 117.56 34.34 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.767 179.773 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.61 HD23 ' CD1' ' A' ' 8' ' ' PHE . 3.6 pp -109.38 133.22 53.33 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.788 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.1 pp -118.07 154.62 31.76 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.841 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.444 ' HA ' HD23 ' A' ' 40' ' ' LEU . 25.9 m -97.06 135.57 38.86 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.76 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.86 5.71 42.53 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.584 179.249 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.2 t70 64.31 39.98 6.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.259 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 6.4 mtp180 68.11 127.83 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.23 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -70.61 91.24 0.79 Allowed 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.797 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.422 HD13 ' N ' ' A' ' 87' ' ' GLU . 0.2 OUTLIER -71.54 124.03 23.76 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.92 -179.886 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.422 ' N ' HD13 ' A' ' 86' ' ' LEU . 35.3 mt-10 -66.81 139.65 57.79 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.222 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -94.65 137.9 33.18 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.043 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.9 -173.71 3.99 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.969 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 38.5 t60 -97.44 145.18 26.44 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.228 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 72.59 -66.85 0.29 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.903 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -164.04 173.87 12.03 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.921 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.236 -0.887 . . . . 0.0 111.306 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 120.957 0.408 . . . . 0.0 111.469 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -153.29 160.67 42.78 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.263 179.87 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.414 ' OD1' ' HB1' ' A' ' 18' ' ' ALA . 3.7 t70 71.78 151.09 0.1 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.043 0.449 . . . . 0.0 111.207 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.4 t -128.32 137.77 56.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.152 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.55 116.08 28.49 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.432 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.698 HD13 ' HD2' ' A' ' 19' ' ' PHE . 4.0 mp -117.67 131.15 71.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.974 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 26.6 tttt -106.63 129.18 54.59 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.929 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -114.73 134.41 55.12 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.881 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.407 ' HB3' HD13 ' A' ' 78' ' ' LEU . 3.4 tt0 -119.21 123.85 45.33 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.962 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.4 t-160 -134.81 115.9 14.2 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.624 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 57.93 32.53 22.07 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.301 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 96.06 -34.77 4.72 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.995 -0.622 . . . . 0.0 112.699 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -65.02 136.41 56.75 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.703 0.287 . . . . 0.0 110.932 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 40.9 mtm-85 -108.61 138.78 44.36 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.158 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -132.81 127.83 35.39 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.798 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.8 mp -110.39 123.95 66.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.923 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 33.6 mt -137.44 131.81 44.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 121.029 0.442 . . . . 0.0 111.034 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.414 ' HB1' ' OD1' ' A' ' 3' ' ' ASP . . . -92.03 134.04 35.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.696 -0.683 . . . . 0.0 111.122 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.698 ' HD2' HD13 ' A' ' 6' ' ' ILE . 11.6 m-85 -116.21 119.26 35.2 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.767 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 93.2 p -74.9 131.18 40.51 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.912 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.3 mtm180 -73.95 151.78 88.6 Favored Pre-proline 0 N--CA 1.463 0.223 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.288 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.14 166.18 82.93 Favored 'Cis proline' 0 C--N 1.351 0.668 0 C-N-CA 123.562 -1.433 . . . . 0.0 112.845 0.132 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.5 p -152.63 153.17 9.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.239 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.551 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -134.31 164.17 28.01 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.491 -179.698 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.462 ' CD2' HD22 ' A' ' 59' ' ' LEU . 6.7 t80 -56.92 -44.65 82.66 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.264 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -58.09 -45.15 87.65 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.396 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.41 ' HB2' ' HG2' ' A' ' 24' ' ' LYS . 2.8 t70 -67.03 -44.42 80.28 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.572 -179.552 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.551 HG23 ' O ' ' A' ' 24' ' ' LYS . 40.0 t -67.9 -46.99 81.01 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.065 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -63.45 -41.49 98.65 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.388 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.6 m80 -56.68 -40.89 76.37 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.641 0.258 . . . . 0.0 111.059 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.797 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.4 OUTLIER -69.78 -49.07 56.44 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.257 -179.962 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 46.4 t -65.39 -42.57 93.83 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 CA-C-N 116.693 -0.231 . . . . 0.0 111.516 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.41 HG23 ' HB3' ' A' ' 38' ' ' GLN . 75.0 m -59.06 -39.67 82.79 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.725 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 29.7 m -72.15 -32.47 66.92 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 121.247 -0.181 . . . . 0.0 111.331 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.797 HG23 ' O ' ' A' ' 31' ' ' LYS . 60.4 t -66.87 -58.28 7.01 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 N-CA-C 111.435 0.161 . . . . 0.0 111.435 -179.652 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.493 ' HB2' HD11 ' A' ' 40' ' ' LEU . 33.0 m-85 -95.85 6.78 48.07 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -179.157 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.506 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 80.09 -176.29 54.72 Favored Glycine 0 C--N 1.336 0.546 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.693 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.41 ' HB3' HG23 ' A' ' 33' ' ' THR . 0.4 OUTLIER -131.28 155.87 80.91 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 120.561 0.22 . . . . 0.0 111.068 -179.9 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -90.61 153.72 25.34 Favored 'Cis proline' 0 C--N 1.349 0.601 0 C-N-CA 123.744 -1.357 . . . . 0.0 113.273 0.28 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.506 HD12 ' O ' ' A' ' 37' ' ' GLY . 21.5 mt -137.41 141.79 41.67 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.933 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -114.33 127.63 55.95 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.936 179.654 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 21.0 mt -92.66 112.84 24.94 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.829 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -110.54 120.65 43.11 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.156 -179.767 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.873 ' HB2' HD21 ' A' ' 53' ' ' LEU . 1.2 t80 -88.76 130.33 35.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.842 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.6 mpp? -126.93 113.96 17.21 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.547 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -72.77 -53.98 10.13 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.733 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -176.68 -56.62 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.343 179.78 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -107.21 -26.79 10.91 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.536 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.487 HD23 ' N ' ' A' ' 50' ' ' SER . 0.9 OUTLIER -114.04 155.61 25.62 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.882 0.372 . . . . 0.0 111.495 -179.576 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.487 ' N ' HD23 ' A' ' 49' ' ' LEU . 0.7 OUTLIER -118.12 124.94 49.25 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.839 179.624 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 9.6 mt -113.87 133.12 60.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.046 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.84 135.87 38.2 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.806 179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.873 HD21 ' HB2' ' A' ' 44' ' ' TYR . 1.0 OUTLIER -95.33 76.68 3.4 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.617 179.915 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 3.0 pttp -77.37 -35.34 54.59 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.489 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -123.14 165.06 17.48 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.075 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.8 tm0? -59.94 -35.86 75.82 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.807 179.289 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -53.81 -49.88 67.37 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.91 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -59.17 -46.0 89.55 Favored 'General case' 0 N--CA 1.461 0.125 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.148 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.462 HD22 ' CD2' ' A' ' 25' ' ' TYR . 6.3 tp -66.15 -41.86 89.83 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.885 179.567 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.833 ' HA ' HD12 ' A' ' 63' ' ' ILE . 11.1 t0 -66.27 -42.34 88.62 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.395 -179.616 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -62.75 -36.52 83.31 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.45 179.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.816 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -63.81 -39.14 93.52 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.205 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.833 HD12 ' HA ' ' A' ' 60' ' ' ASP . 8.2 mt -64.53 -42.78 96.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.798 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.11 -37.69 67.18 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.945 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.816 HD12 ' HA ' ' A' ' 62' ' ' ALA . 9.5 mt -65.86 -41.69 90.6 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.879 179.657 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.497 HD13 HD12 ' A' ' 75' ' ' LEU . 5.9 tt -61.42 -44.21 97.53 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.865 179.541 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.79 -34.41 78.28 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.076 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -67.32 -32.63 73.72 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.406 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.7 t -103.92 109.05 20.66 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.294 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 47.5 t -77.7 -9.17 58.84 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.3 p -89.65 42.53 1.1 Allowed 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 120.758 0.313 . . . . 0.0 111.66 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.81 -173.67 3.63 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.691 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.7 mttm -130.87 -69.05 0.66 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.652 0.263 . . . . 0.0 111.012 179.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -130.52 -173.01 2.95 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.058 -179.677 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.497 HD12 HD13 ' A' ' 66' ' ' LEU . 1.9 mp -91.9 121.54 33.59 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.452 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.9 tpt180 -76.81 80.34 3.41 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.002 0.429 . . . . 0.0 110.74 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.549 HD12 ' CG2' ' A' ' 6' ' ' ILE . 26.5 mt -103.93 123.24 57.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.754 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.407 HD13 ' HB3' ' A' ' 9' ' ' GLU . 4.0 mm? -103.29 117.29 34.17 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.819 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.1 pp -105.7 127.77 53.27 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.568 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.3 mp -119.82 127.62 52.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.127 -179.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -98.2 131.17 44.78 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.986 179.616 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.1 5.28 47.49 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.49 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -110.37 127.62 55.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.699 -179.753 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.51 92.26 4.0 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.843 0.354 . . . . 0.0 110.864 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -125.56 -177.87 4.05 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.829 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 64.66 48.19 2.63 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.054 0.454 . . . . 0.0 110.882 -179.589 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -78.27 -45.11 23.67 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.826 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -164.62 175.18 10.03 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.623 179.721 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -85.02 -43.65 13.76 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.819 179.703 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER 63.0 -173.89 0.15 Allowed 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.228 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 9.8 p80 -106.1 29.18 6.96 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.103 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 21.4 p80 -168.57 133.59 1.67 Allowed 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.974 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.219 -0.896 . . . . 0.0 111.585 -179.95 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 121.039 0.447 . . . . 0.0 111.105 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.9 m -150.82 171.51 17.1 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.602 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -63.05 104.44 0.57 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.901 0.381 . . . . 0.0 110.87 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 23.2 t -78.48 130.08 36.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.348 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -87.76 123.58 32.71 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.928 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 3.1 mt -118.06 124.53 73.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.643 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.7 mttp -95.07 121.24 36.5 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.796 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -113.15 131.72 55.74 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.689 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.634 ' HB2' HD12 ' A' ' 78' ' ' LEU . 0.6 OUTLIER -119.22 127.91 53.71 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.182 -179.826 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 12.9 t-160 -130.98 117.19 18.84 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.522 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 56.33 32.27 20.16 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.548 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 96.26 -28.08 14.43 Favored Glycine 0 C--N 1.335 0.508 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.012 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.5 148.19 52.15 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.829 0.347 . . . . 0.0 111.273 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.7 ptp85 -109.07 142.59 39.56 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.113 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -141.87 139.95 32.76 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.227 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.1 mp -115.38 131.72 66.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.233 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.739 HD13 ' N ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -145.34 131.38 14.15 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.237 -179.944 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.739 ' N ' HD13 ' A' ' 17' ' ' ILE . . . -103.88 127.68 51.38 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.059 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.649 ' CD2' HD12 ' A' ' 17' ' ' ILE . 5.1 m-85 -113.28 120.7 42.09 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.087 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.3 m -82.55 128.53 34.39 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.931 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.0 mtm180 -78.33 156.8 78.53 Favored Pre-proline 0 N--CA 1.464 0.233 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.912 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.68 126.37 12.89 Favored 'Cis proline' 0 C--N 1.351 0.667 0 C-N-CA 123.566 -1.431 . . . . 0.0 112.667 -0.147 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.1 p -103.25 147.05 10.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.454 -179.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.412 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -110.66 146.11 36.77 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.109 -179.909 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -59.68 -39.6 85.04 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.629 179.258 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -43.83 98.14 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.837 179.682 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -64.96 -44.34 89.7 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.425 -179.793 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.673 ' O ' HG23 ' A' ' 32' ' ' VAL . 43.1 t -68.18 -47.3 78.89 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.125 0 CA-C-O 120.605 0.24 . . . . 0.0 111.156 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.435 ' HG3' HD11 ' A' ' 42' ' ' LEU . 1.4 tt0 -64.28 -45.45 87.98 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.136 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -58.95 -44.36 91.43 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.752 0.31 . . . . 0.0 110.596 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.721 ' O ' HG23 ' A' ' 35' ' ' VAL . 1.2 tttt -64.05 -49.47 72.23 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.228 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.673 HG23 ' O ' ' A' ' 28' ' ' VAL . 43.6 t -64.09 -41.05 91.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-N 116.764 -0.198 . . . . 0.0 111.323 -179.621 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 95.9 m -61.34 -39.5 90.79 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.993 179.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.3 m -72.42 -40.97 66.73 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 121.137 -0.225 . . . . 0.0 111.344 179.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.721 HG23 ' O ' ' A' ' 31' ' ' LYS . 47.3 t -64.84 -55.1 22.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.173 0 CA-C-O 120.67 0.271 . . . . 0.0 111.353 -179.531 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -85.95 -7.45 58.66 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -179.23 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.411 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 86.03 177.15 50.01 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.571 -179.798 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.94 154.43 79.22 Favored Pre-proline 0 N--CA 1.465 0.301 0 CA-C-O 120.571 0.224 . . . . 0.0 111.044 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -86.91 153.52 45.12 Favored 'Cis proline' 0 C--N 1.349 0.59 0 C-N-CA 123.655 -1.394 . . . . 0.0 113.449 0.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.599 HD23 ' HA ' ' A' ' 81' ' ' SER . 32.6 mt -138.38 157.1 46.89 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.923 179.712 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -114.43 118.44 33.83 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.002 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.435 HD11 ' HG3' ' A' ' 29' ' ' GLU . 37.5 mt -79.84 100.1 7.84 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.892 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.4 m170 -103.73 112.26 25.13 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.874 0.369 . . . . 0.0 111.247 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -94.96 115.89 28.02 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.23 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.3 ttm -101.84 124.95 48.34 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.986 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -79.56 -41.1 27.95 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.712 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -171.81 -64.17 0.02 OUTLIER 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.334 179.675 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.81 -29.49 7.95 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.576 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -107.2 155.3 20.05 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.852 0.358 . . . . 0.0 111.291 -179.42 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.6 t -114.81 132.95 56.31 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.983 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 28.9 mt -125.39 134.34 67.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.694 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.5 tt -83.14 132.71 35.07 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.652 0.263 . . . . 0.0 111.093 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.1 mt -87.27 110.67 20.36 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.64 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.07 -64.06 1.18 Allowed 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.45 -179.545 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -136.13 -169.04 2.34 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.82 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -54.12 -30.77 50.1 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.533 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -54.14 -42.31 69.38 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.62 0.247 . . . . 0.0 111.119 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.42 -48.46 69.96 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.806 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.3 tt -64.23 -39.63 94.37 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.201 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.643 ' HA ' HD12 ' A' ' 63' ' ' ILE . 10.4 m-20 -61.81 -43.28 99.16 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.746 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.19 -36.33 83.7 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.643 179.311 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.68 -38.95 92.38 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.327 179.571 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.643 HD12 ' HA ' ' A' ' 60' ' ' ASP . 13.6 mt -64.35 -44.4 97.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.8 0.333 . . . . 0.0 110.642 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -56.48 -42.82 78.9 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.053 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 27.2 mt -69.19 -38.33 77.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.805 179.648 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 9.6 tp -60.5 -46.0 91.72 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.865 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -60.61 -36.15 77.87 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.718 179.586 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.6 ttm-85 -63.15 -33.0 74.52 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.28 179.598 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 31.1 t -72.3 150.9 43.14 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 120.664 0.269 . . . . 0.0 111.219 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 4.4 m -81.03 -33.04 33.86 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.493 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.0 p -74.07 -69.22 0.46 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.67 -0.241 . . . . 0.0 111.532 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.7 ttt 54.14 81.41 0.1 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.872 0.368 . . . . 0.0 111.016 -179.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.6 ptpt -128.78 85.63 2.35 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.001 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.5 t 66.06 -179.83 0.2 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.384 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.7 mp -109.49 131.55 54.96 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.114 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.7 mtt85 -87.64 88.15 7.59 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.993 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 23.1 mt -122.39 127.31 75.06 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.132 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.931 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.634 HD12 ' HB2' ' A' ' 9' ' ' GLU . 0.6 OUTLIER -116.62 117.43 29.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.858 179.942 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.9 pp -96.2 127.97 42.69 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.804 0.335 . . . . 0.0 110.764 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.3 mp -112.79 147.51 36.76 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.353 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.599 ' HA ' HD23 ' A' ' 40' ' ' LEU . 1.3 p -95.1 147.47 23.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.824 179.695 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -85.47 5.46 31.12 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.227 -0.442 . . . . 0.0 112.03 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.72 70.89 3.52 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.922 0.392 . . . . 0.0 110.596 179.555 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 51.0 mtt180 -129.37 103.2 6.79 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.697 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -86.92 -70.19 0.63 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.099 -179.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.79 -31.84 69.97 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.809 179.747 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -79.27 98.5 6.68 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.197 -179.737 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -169.16 42.18 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.529 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -174.2 158.65 3.04 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.485 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -171.19 -53.12 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.653 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -166.76 133.58 2.44 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.399 179.685 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 45.9 t-80 68.64 107.8 0.05 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.499 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 16.6 p80 . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.517 -0.754 . . . . 0.0 111.13 179.376 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.709 0 CA-C-O 120.548 0.213 . . . . 0.0 111.529 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.9 m 65.88 159.84 0.13 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.456 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 65.34 116.08 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.145 -179.706 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 15.4 t -106.3 128.98 60.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.336 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -86.88 115.85 24.56 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.676 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.454 HG21 ' CZ ' ' A' ' 8' ' ' PHE . 20.1 mm -104.74 125.69 59.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.134 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.8 ttmt -100.92 116.15 32.11 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.636 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.454 ' CZ ' HG21 ' A' ' 6' ' ' ILE . 54.5 m-85 -109.55 132.61 53.97 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.717 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -119.51 133.61 55.6 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.196 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -141.11 116.11 9.84 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.81 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 34.8 m-20 56.05 35.66 25.99 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.339 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.45 -27.93 12.44 Favored Glycine 0 CA--C 1.525 0.677 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.963 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.55 150.16 47.35 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.715 0.257 . . . . 0.0 111.145 179.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.6 mtm-85 -125.75 143.82 50.89 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.397 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.23 132.36 16.34 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.165 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.5 mt -109.3 122.97 64.79 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.742 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 26.4 mt -133.08 130.18 57.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.122 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -97.54 131.18 44.38 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.098 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -112.96 117.04 30.97 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.745 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.85 140.1 47.37 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.846 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.47 150.91 95.68 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.978 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.74 132.44 26.91 Favored 'Cis proline' 0 C--N 1.35 0.606 0 C-N-CA 123.298 -1.543 . . . . 0.0 112.731 0.114 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.6 p -89.64 124.43 42.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.718 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.543 ' O ' HG23 ' A' ' 28' ' ' VAL . 6.4 mttt -113.21 134.47 54.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.941 -179.497 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -56.54 -46.46 80.65 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.076 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.22 -44.91 88.43 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.025 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -65.12 -44.67 87.96 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.304 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.543 HG23 ' O ' ' A' ' 24' ' ' LYS . 45.4 t -67.71 -47.26 80.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.777 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -59.71 -44.29 93.78 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.653 179.472 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.445 ' HA ' HG22 ' A' ' 33' ' ' THR . 3.7 t60 -57.89 -38.91 76.66 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.239 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.737 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.6 OUTLIER -69.82 -49.96 47.58 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.799 -0.182 . . . . 0.0 111.099 179.924 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.8 t -67.49 -43.33 87.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.445 HG22 ' HA ' ' A' ' 30' ' ' HIS . 5.9 t -59.8 -39.1 83.84 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.526 -179.555 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.3 m -72.12 -39.9 68.52 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 111.474 0.176 . . . . 0.0 111.474 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.737 HG23 ' O ' ' A' ' 31' ' ' LYS . 60.8 t -60.66 -55.75 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 120.508 0.194 . . . . 0.0 111.314 -179.524 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.539 ' CE2' HD11 ' A' ' 79' ' ' LEU . 40.9 m-85 -84.6 -20.06 32.04 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -179.394 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.4 178.22 41.38 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.6 -179.579 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -126.38 160.2 59.08 Favored Pre-proline 0 CA--C 1.53 0.201 0 CA-C-O 120.586 0.232 . . . . 0.0 110.85 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -83.82 146.34 52.36 Favored 'Cis proline' 0 C--N 1.351 0.686 0 C-N-CA 123.521 -1.45 . . . . 0.0 113.221 0.14 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.705 HD23 ' HA ' ' A' ' 81' ' ' SER . 17.3 mt -137.52 146.58 44.35 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.918 179.582 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -116.35 134.51 54.81 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.165 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.33 114.51 27.06 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.876 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -114.3 111.58 21.72 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.073 -179.516 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 16.8 t80 -93.4 121.9 35.26 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.276 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.1 ptt? -123.98 132.2 53.67 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.843 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -97.51 -47.89 5.49 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.358 179.546 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -163.72 -71.32 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.26 179.204 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -109.85 -25.72 10.17 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.453 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -103.6 140.74 37.14 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.76 0.314 . . . . 0.0 111.256 -179.607 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.3 m -112.37 132.25 55.11 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.698 179.357 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 30.0 mm -114.54 133.87 59.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.774 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.21 120.71 32.36 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.853 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.577 HD23 ' HB3' ' A' ' 58' ' ' ASP . 40.5 mt -104.61 125.27 50.58 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.57 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.2 ttmp? -128.5 -55.73 1.24 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.971 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.4 m-20 -104.53 174.58 5.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.792 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -58.98 -33.9 71.2 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.944 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.95 -48.53 67.28 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 120.579 0.228 . . . . 0.0 111.279 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.577 ' HB3' HD23 ' A' ' 53' ' ' LEU . 14.6 m-20 -63.26 -47.19 83.4 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.564 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 20.5 tp -63.43 -40.23 96.61 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.44 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -61.48 -43.3 99.1 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.607 -0.27 . . . . 0.0 110.813 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -34.72 78.76 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.814 179.291 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.99 -35.23 79.52 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.138 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 31.3 mm -59.64 -46.52 93.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.473 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -53.16 -43.51 67.09 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.849 179.365 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 32.3 mt -65.24 -43.15 95.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.311 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.461 HD21 ' O ' ' A' ' 74' ' ' SER . 0.1 OUTLIER -69.24 -48.09 62.85 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.886 0.374 . . . . 0.0 110.728 179.683 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.03 -40.33 76.52 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.6 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 37.3 ptt85 -69.02 -29.7 67.93 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 111.58 0.215 . . . . 0.0 111.58 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 64.7 p -76.12 116.75 17.13 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 120.732 0.301 . . . . 0.0 110.828 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 50.5 p -74.4 -48.97 24.49 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.246 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.17 -48.06 77.45 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.283 -179.622 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.06 145.64 49.77 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.016 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.9 mttp -136.66 -51.93 0.69 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.074 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.461 ' O ' HD21 ' A' ' 66' ' ' LEU . 0.7 OUTLIER -81.1 166.1 21.01 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.886 179.927 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -101.05 126.67 47.75 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.182 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.0 mtt180 -93.33 81.99 4.46 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.05 0.453 . . . . 0.0 110.851 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.3 mt -107.27 114.16 45.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.558 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.81 117.05 34.04 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.54 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.539 HD11 ' CE2' ' A' ' 36' ' ' PHE . 0.2 OUTLIER -104.72 135.89 45.26 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.881 179.91 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -139.97 154.7 47.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.83 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.705 ' HA ' HD23 ' A' ' 40' ' ' LEU . 60.5 m -70.73 142.96 51.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.079 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLN . . . . . 0.536 ' O ' HD13 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -85.93 5.57 32.47 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 179.765 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.44 56.95 4.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.084 0.468 . . . . 0.0 110.929 179.543 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -102.12 -40.73 6.69 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.48 179.371 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -165.16 -68.01 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.904 179.472 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.536 HD13 ' O ' ' A' ' 82' ' ' GLN . 3.4 mp 60.97 171.31 0.1 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.969 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -172.55 -51.78 0.02 OUTLIER 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.735 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -159.0 84.1 0.8 Allowed 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.245 179.717 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -114.29 -43.64 3.19 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.41 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -86.29 50.78 2.06 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 120.846 0.355 . . . . 0.0 111.106 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -163.04 35.9 0.1 Allowed 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.391 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -126.62 96.89 4.81 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.601 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.579 -0.724 . . . . 0.0 111.252 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.4 t0 . . . . . 0 N--CA 1.465 0.309 0 CA-C-O 120.842 0.353 . . . . 0.0 111.055 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.9 t -94.91 116.37 36.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.269 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -87.25 115.42 24.63 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.735 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.512 HG12 HD13 ' A' ' 75' ' ' LEU . 22.7 mt -114.25 126.47 71.77 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.933 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.9 mtpt -100.65 115.45 30.24 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.873 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -101.58 138.93 37.93 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.025 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -122.44 128.17 50.55 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.962 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 25.2 t-80 -142.86 112.02 6.6 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.57 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 59.21 34.06 22.95 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.114 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.73 -31.01 6.82 Favored Glycine 0 CA--C 1.524 0.602 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.815 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -65.41 142.99 58.0 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.873 0.368 . . . . 0.0 111.151 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -119.71 143.55 47.71 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.362 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.92 134.89 30.65 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.948 179.617 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 22.1 mt -105.77 118.17 52.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.88 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.8 mt -128.33 129.9 69.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.179 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.46 147.44 23.54 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.2 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.402 ' CD2' HD12 ' A' ' 6' ' ' ILE . 13.0 m-85 -130.38 138.8 50.56 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.287 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.5 p -94.98 119.83 34.16 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.948 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.5 mtt180 -68.61 150.32 97.7 Favored Pre-proline 0 N--CA 1.464 0.254 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.893 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -72.72 144.43 80.77 Favored 'Cis proline' 0 C--N 1.35 0.623 0 C-N-CA 123.776 -1.343 . . . . 0.0 112.425 0.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.3 p -113.2 123.61 69.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.027 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.608 ' O ' HG23 ' A' ' 28' ' ' VAL . 3.7 mptt -101.01 137.52 39.27 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.048 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.713 ' HB2' HD22 ' A' ' 59' ' ' LEU . 66.0 t80 -54.78 -40.36 69.35 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.036 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -63.19 -45.31 92.34 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.973 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -64.37 -44.41 91.47 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.131 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.608 HG23 ' O ' ' A' ' 24' ' ' LYS . 26.3 t -62.46 -46.8 95.53 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.663 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.05 -46.07 85.97 Favored 'General case' 0 CA--C 1.528 0.111 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.038 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.05 -42.07 79.87 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 120.6 0.238 . . . . 0.0 111.246 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.787 ' O ' HG23 ' A' ' 35' ' ' VAL . 38.9 tttp -71.1 -49.8 40.47 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.25 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 28' ' ' VAL . 39.6 t -64.82 -41.53 92.42 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.765 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 54.9 m -58.81 -39.43 81.14 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.905 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.4 m -71.91 -36.81 70.09 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 121.369 -0.132 . . . . 0.0 111.258 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.787 HG23 ' O ' ' A' ' 31' ' ' LYS . 42.3 t -61.21 -55.18 26.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 N-CA-C 111.541 0.2 . . . . 0.0 111.541 -179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.641 ' CE2' HD21 ' A' ' 79' ' ' LEU . 71.4 m-85 -89.96 -19.68 24.21 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -178.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.431 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 105.07 179.24 24.24 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.301 -179.464 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -139.92 154.17 70.35 Favored Pre-proline 0 N--CA 1.464 0.271 0 O-C-N 122.819 -0.224 . . . . 0.0 110.914 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -85.84 148.73 44.04 Favored 'Cis proline' 0 C--N 1.351 0.684 0 C-N-CA 123.607 -1.414 . . . . 0.0 113.207 0.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.658 HD23 ' HA ' ' A' ' 81' ' ' SER . 20.0 mt -138.74 158.59 43.95 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.03 179.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -113.3 140.35 48.07 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.002 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.473 ' O ' HD13 ' A' ' 52' ' ' LEU . 12.9 mt -102.75 107.08 17.84 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.196 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -104.03 125.65 50.55 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.128 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -114.53 130.3 56.74 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.408 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 9.4 ptp -128.62 122.16 30.28 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.853 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -79.91 -59.7 2.63 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.462 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -175.03 -55.75 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.463 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -106.8 -26.32 11.32 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.551 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.3 mt -123.36 145.68 48.55 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.715 0.293 . . . . 0.0 111.248 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 56.1 p -120.82 132.78 55.2 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.811 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mp -126.94 132.53 69.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.972 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.473 HD13 ' O ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -85.33 118.98 25.2 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.323 179.783 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 26.8 mt -65.89 105.73 1.38 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.945 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.0 mttp -110.88 -35.82 5.85 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.222 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -136.47 171.91 13.79 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.105 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -58.2 -29.94 66.07 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.119 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.438 ' HA ' ' OD2' ' A' ' 60' ' ' ASP . 1.2 m-20 -56.26 -43.5 78.79 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.116 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -66.89 -32.22 73.34 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.799 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.713 HD22 ' HB2' ' A' ' 25' ' ' TYR . 33.1 tp -64.86 -45.44 86.08 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.726 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.438 ' OD2' ' HA ' ' A' ' 57' ' ' ASP . 2.5 p30 -70.56 -31.85 69.03 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.577 0.227 . . . . 0.0 110.975 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -38.02 89.06 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.713 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.43 -42.98 86.92 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.2 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.3 mm -66.34 -41.69 89.36 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.156 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -55.15 -45.46 75.67 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.192 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.6 mt -66.57 -39.27 83.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.813 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 20.0 tp -64.56 -43.67 93.2 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.877 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -57.16 -42.68 81.55 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.069 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.71 -31.95 72.96 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.073 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 27.5 t -79.03 146.18 33.46 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.128 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.63 -18.75 62.18 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.541 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 60.3 p -93.57 38.2 1.06 Allowed 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.756 0.312 . . . . 0.0 111.554 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.35 84.71 4.51 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.639 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp -138.93 -58.99 0.6 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.929 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.1 p -112.99 168.22 9.87 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.041 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.512 HD13 HG12 ' A' ' 6' ' ' ILE . 5.5 mp -122.62 138.81 54.48 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.038 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 7.4 ttp180 -97.31 87.57 4.19 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.982 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.1 mt -117.68 118.2 57.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.691 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.3 tt -108.52 128.65 54.99 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.178 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.641 HD21 ' CE2' ' A' ' 36' ' ' PHE . 3.5 pp -113.76 136.61 52.67 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.846 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -135.6 148.19 48.95 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.163 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . 0.658 ' HA ' HD23 ' A' ' 40' ' ' LEU . 2.6 p -72.65 147.39 45.81 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.391 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 . . . . . 0 CA--C 1.535 0.369 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -179.556 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.6 t0 . . . . . 0 C--O 1.235 0.3 0 CA-C-O 120.677 0.275 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 22.2 t -96.08 123.19 48.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.888 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.7 mtt180 -87.29 114.81 24.23 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.951 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.491 HG21 HD12 ' A' ' 77' ' ' ILE . 23.7 mt -105.9 118.51 53.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.827 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -103.65 114.7 29.16 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.363 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.513 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 0.9 OUTLIER -117.6 145.53 44.25 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.921 -179.774 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -119.21 139.88 51.12 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.615 -179.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . 0.52 ' HB2' HD11 ' A' ' 79' ' ' LEU . 24.5 t-80 -141.02 114.65 8.89 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.364 179.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 51.3 m-20 57.63 33.47 23.29 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.657 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.14 -47.0 1.14 Allowed Glycine 0 C--N 1.336 0.545 0 C-N-CA 120.863 -0.684 . . . . 0.0 113.36 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.24 145.39 51.39 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.815 0.34 . . . . 0.0 110.997 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 ptp180 -124.1 147.66 47.74 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.622 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.513 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -131.02 137.33 49.14 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.749 179.641 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 19.1 mt -117.41 126.32 74.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.908 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 28.0 mt -138.98 131.6 37.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.957 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.37 145.73 24.72 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.179 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -131.13 125.36 32.89 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.116 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 40.7 t -71.39 126.68 30.29 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.007 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 25.6 mtt85 -71.6 144.91 89.3 Favored Pre-proline 0 CA--C 1.53 0.192 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.031 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -77.38 123.12 9.2 Favored 'Cis proline' 0 C--N 1.349 0.581 0 C-N-CA 123.193 -1.586 . . . . 0.0 112.612 -0.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.3 p -72.27 145.4 12.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.058 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.576 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.5 mmmt -111.38 132.28 54.55 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.259 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.401 ' HD1' HD13 ' A' ' 59' ' ' LEU . 64.4 t80 -57.46 -43.29 83.88 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.895 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -59.19 -43.56 92.21 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.167 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.402 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -65.7 -44.57 85.74 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.346 -179.955 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.576 HG23 ' O ' ' A' ' 24' ' ' LYS . 23.7 t -65.39 -47.97 84.9 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.738 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.51 ' HG2' HD11 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -63.67 -46.14 86.92 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.345 179.912 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 67.2 t60 -56.38 -41.01 75.51 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.535 0.207 . . . . 0.0 111.443 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.78 ' O ' HG23 ' A' ' 35' ' ' VAL . 8.4 tttp -71.05 -49.79 40.97 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.341 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 28' ' ' VAL . 46.5 t -66.4 -43.01 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.602 -179.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 53.4 m -59.05 -39.24 81.42 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.314 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.5 m -72.2 -36.69 69.26 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.399 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.78 HG23 ' O ' ' A' ' 31' ' ' LYS . 57.0 t -62.34 -51.6 70.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -95.59 -18.09 20.85 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -178.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.679 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 105.93 -177.51 22.58 Favored Glycine 0 CA--C 1.523 0.557 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.599 -179.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.411 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 7.6 pm0 -134.08 155.43 80.07 Favored Pre-proline 0 N--CA 1.463 0.219 0 O-C-N 122.776 -0.249 . . . . 0.0 111.098 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.411 ' HA ' ' HB2' ' A' ' 38' ' ' GLN . 83.4 Cg_endo -90.0 145.1 17.82 Favored 'Cis proline' 0 C--N 1.348 0.508 0 C-N-CA 123.651 -1.396 . . . . 0.0 113.101 0.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.679 HD12 ' O ' ' A' ' 37' ' ' GLY . 23.2 mt -138.49 139.87 38.96 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.831 179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -112.4 140.28 47.27 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.092 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.51 HD11 ' HG2' ' A' ' 29' ' ' GLU . 3.7 mt -87.45 113.97 23.63 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.036 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -106.04 117.54 34.28 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.014 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.403 ' HB3' HD23 ' A' ' 53' ' ' LEU . 14.2 t80 -107.17 122.84 47.31 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 120.783 0.325 . . . . 0.0 110.697 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 28.2 mtp -110.62 128.17 55.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.431 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -71.3 -56.42 6.05 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.711 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -178.86 -52.99 0.01 OUTLIER 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.329 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -104.73 -29.73 10.38 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.53 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -119.68 160.35 22.69 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.876 0.37 . . . . 0.0 111.522 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.5 m -104.64 132.33 51.02 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.988 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 25.1 mm -116.02 133.45 62.44 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.916 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.0 mt -104.4 125.15 50.35 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.89 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.403 HD23 ' HB3' ' A' ' 44' ' ' TYR . 0.9 OUTLIER -119.59 106.13 11.88 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.398 179.924 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -107.77 -34.43 6.97 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.137 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -98.23 166.11 11.56 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.626 0.25 . . . . 0.0 110.825 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.06 -35.64 80.93 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.04 179.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -52.84 -47.05 68.02 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.141 179.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.4 -31.66 72.56 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.177 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.401 HD13 ' HD1' ' A' ' 25' ' ' TYR . 6.0 tp -72.69 -39.03 67.34 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.68 -0.236 . . . . 0.0 110.552 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.86 -43.5 98.71 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.268 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -66.63 -38.84 87.77 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.818 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.31 -45.0 93.38 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.562 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 14.1 mt -66.37 -41.13 88.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.894 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -55.08 -44.96 75.33 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.039 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.3 mt -64.82 -43.11 96.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.733 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.753 HD12 ' HB3' ' A' ' 72' ' ' MET . 9.2 tp -62.01 -47.3 85.39 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.129 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.97 -37.49 87.84 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.246 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -72.61 -35.27 67.82 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.069 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.0 t -76.39 128.26 34.47 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.39 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 27.9 p -75.09 -38.43 61.22 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.826 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.74 -47.16 32.74 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.171 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.753 ' HB3' HD12 ' A' ' 66' ' ' LEU . 1.8 mpp? -78.79 91.76 4.76 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.113 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.9 mtpt -97.0 -45.81 6.44 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.184 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.465 ' O ' HD11 ' A' ' 66' ' ' LEU . 2.8 p -91.0 151.2 21.15 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.902 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.699 ' HG ' HD22 ' A' ' 66' ' ' LEU . 0.2 OUTLIER -91.98 124.15 35.87 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.01 -179.955 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -93.68 88.9 6.0 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.878 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.491 HD12 HG21 ' A' ' 6' ' ' ILE . 31.1 mt -111.93 117.66 55.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.583 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.589 HD23 HD11 ' A' ' 80' ' ' LEU . 4.9 tp -102.06 123.69 46.37 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.852 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.52 HD11 ' HB2' ' A' ' 10' ' ' HIS . 2.3 pp -112.07 130.99 55.7 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.778 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.589 HD11 HD23 ' A' ' 78' ' ' LEU . 0.4 OUTLIER -131.5 142.69 50.01 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.988 -179.439 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.51 143.79 27.55 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.859 179.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.305 0 CA-C-N 115.971 -0.558 . . . . 0.0 112.1 179.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 p30 . . . . . 0 N--CA 1.464 0.243 0 CA-C-O 121.162 0.506 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 23.1 t -90.42 116.38 31.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.926 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.6 mtt180 -90.06 121.79 32.46 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.744 0.307 . . . . 0.0 111.049 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.534 HG23 ' HB2' ' A' ' 75' ' ' LEU . 2.6 mt -115.57 130.06 70.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.989 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.4 tttm -95.45 126.89 41.06 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.699 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -117.1 136.25 53.14 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.282 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.728 ' HB3' HD12 ' A' ' 78' ' ' LEU . 1.6 mt-10 -121.96 127.54 50.47 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.074 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.6 t-80 -131.13 112.57 12.98 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.686 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 55.67 34.76 23.92 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.523 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 98.69 -35.42 4.64 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.686 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.79 136.58 57.07 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.716 0.293 . . . . 0.0 110.817 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.13 145.29 41.19 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.621 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.63 130.2 13.97 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.087 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.9 mp -102.49 125.8 56.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.808 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.6 mt -130.38 134.29 62.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.219 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.27 138.8 31.22 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.248 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.492 ' CD1' HD12 ' A' ' 6' ' ' ILE . 38.5 m-85 -130.78 117.4 19.32 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.76 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.1 m -76.85 143.34 39.77 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.728 0.299 . . . . 0.0 111.188 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.5 mtm105 -96.05 154.98 38.75 Favored Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.125 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -73.12 142.44 74.76 Favored 'Cis proline' 0 C--N 1.349 0.597 0 C-N-CA 123.57 -1.429 . . . . 0.0 112.335 -0.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.5 p -128.41 147.58 32.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.944 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.483 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -115.97 143.96 44.73 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.007 -179.875 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.554 ' OH ' HD12 ' A' ' 42' ' ' LEU . 64.3 t80 -56.52 -36.95 69.8 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.285 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.87 -44.93 91.19 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.9 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.44 ' HB2' ' HG2' ' A' ' 24' ' ' LYS . 8.7 t0 -69.63 -44.3 70.9 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.007 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.689 ' O ' HG23 ' A' ' 32' ' ' VAL . 38.7 t -64.52 -46.16 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.866 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -58.65 -42.19 87.81 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.286 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -57.42 -46.1 83.88 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.742 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.714 ' O ' HG23 ' A' ' 35' ' ' VAL . 18.5 tttp -70.18 -48.78 55.77 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.943 179.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.689 HG23 ' O ' ' A' ' 28' ' ' VAL . 44.4 t -58.81 -42.37 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-N 116.76 -0.2 . . . . 0.0 111.318 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 86.4 m -64.19 -39.58 94.3 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.056 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 60.1 m -72.47 -42.72 64.63 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.449 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.714 HG23 ' O ' ' A' ' 31' ' ' LYS . 57.5 t -61.98 -51.37 73.34 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.405 ' CE2' HD21 ' A' ' 79' ' ' LEU . 41.7 m-85 -87.81 -20.95 25.39 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -179.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.405 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 103.49 -175.72 23.76 Favored Glycine 0 C--N 1.337 0.631 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.676 -179.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -144.32 155.46 57.73 Favored Pre-proline 0 N--CA 1.465 0.316 0 CA-C-O 120.528 0.204 . . . . 0.0 111.01 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -84.09 137.63 28.16 Favored 'Cis proline' 0 C--N 1.35 0.641 0 C-N-CA 123.546 -1.439 . . . . 0.0 113.205 0.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.687 HD23 ' HA ' ' A' ' 81' ' ' SER . 97.8 mt -137.18 130.41 31.02 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.744 179.488 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -105.09 139.86 39.13 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.729 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.622 HD23 ' HB3' ' A' ' 79' ' ' LEU . 64.7 mt -92.16 108.53 20.01 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.808 0.337 . . . . 0.0 110.94 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -109.36 117.74 34.83 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.495 -179.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.745 ' HB2' HD11 ' A' ' 53' ' ' LEU . 12.4 t80 -96.1 124.52 40.14 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.392 179.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 53.4 mtp -117.56 125.87 51.57 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.542 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.1 t30 -87.48 -52.61 5.26 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.777 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -173.58 -62.55 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.369 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -108.82 -25.55 10.73 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.565 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -111.93 149.33 32.07 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.823 0.344 . . . . 0.0 111.147 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.6 m -113.22 131.15 56.01 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.978 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.8 mt -121.63 133.99 66.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.909 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.9 mp -105.34 124.65 49.9 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.709 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.745 HD11 ' HB2' ' A' ' 44' ' ' TYR . 1.2 mp -91.81 92.61 8.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.721 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 42.8 mttm -111.17 30.44 6.9 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.134 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -175.97 167.39 3.02 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.912 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -63.13 -38.95 93.22 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.311 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.36 -44.45 80.14 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.338 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -64.78 -46.16 83.27 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.001 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 33.0 tp -61.26 -41.25 96.58 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.664 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -61.17 -43.09 99.43 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.575 179.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.3 mttm -65.31 -38.67 90.92 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.011 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.54 -41.35 98.82 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.015 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 18.8 mt -64.9 -43.84 96.25 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.081 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.662 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.67 -45.06 73.83 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.206 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 41.5 mt -68.36 -45.24 82.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.353 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.628 HD13 ' C ' ' A' ' 66' ' ' LEU . 1.5 tm? -65.92 -48.05 72.7 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.041 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.401 ' N ' HD13 ' A' ' 66' ' ' LEU . 1.9 t70 -60.2 -41.77 93.67 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.296 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -74.15 -31.65 62.81 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.66 -179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 76.9 p -80.91 112.07 17.96 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.6 0.238 . . . . 0.0 110.663 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 53.0 m -71.43 -30.32 65.91 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.062 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.16 -34.09 71.68 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.587 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 5.9 ttm -111.61 140.97 45.79 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.649 0.261 . . . . 0.0 111.053 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.4 mttt -115.46 -44.36 2.98 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.118 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 67.5 m -100.46 170.98 8.03 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.745 179.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.534 ' HB2' HG23 ' A' ' 6' ' ' ILE . 0.7 OUTLIER -91.87 120.6 32.71 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.786 179.941 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.0 mmt85 -91.76 73.98 5.78 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.537 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 36.0 mt -111.34 124.71 68.37 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.833 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.728 HD12 ' HB3' ' A' ' 9' ' ' GLU . 4.9 tp -102.08 119.63 39.11 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.863 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.622 ' HB3' HD23 ' A' ' 42' ' ' LEU . 2.0 pp -106.86 125.07 50.53 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.888 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.435 ' O ' HD12 ' A' ' 80' ' ' LEU . 1.0 OUTLIER -116.8 162.75 17.21 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.282 179.941 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . 0.687 ' HA ' HD23 ' A' ' 40' ' ' LEU . 40.6 t -88.21 137.4 32.36 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.993 179.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 10.8 tp60 . . . . . 0 CA--C 1.533 0.291 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.687 179.373 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.412 0 CA-C-O 120.967 0.413 . . . . 0.0 111.205 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.8 t -86.06 110.48 19.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.982 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.26 108.8 19.11 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.688 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 19.5 mt -109.54 128.45 65.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.837 0.351 . . . . 0.0 111.44 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -101.35 123.4 45.38 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.828 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.619 ' CZ ' HG21 ' A' ' 32' ' ' VAL . 84.7 m-85 -115.03 139.88 49.51 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.041 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -124.26 125.44 44.39 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.959 0.409 . . . . 0.0 111.102 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.4 t-80 -138.25 124.02 19.89 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.513 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 57.64 32.07 21.31 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.29 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.36 -41.38 2.59 Favored Glycine 0 C--N 1.337 0.607 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.816 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -68.87 152.25 45.54 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 120.778 0.323 . . . . 0.0 111.332 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.15 151.43 35.67 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.186 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.3 mtt85 -128.5 127.51 42.56 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.736 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.511 ' O ' HD13 ' A' ' 17' ' ' ILE . 2.8 mt -98.18 117.02 42.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.747 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.511 HD13 ' O ' ' A' ' 16' ' ' ILE . 25.5 mm -131.2 133.42 62.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-O 120.826 0.346 . . . . 0.0 111.068 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -107.41 136.88 46.47 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.047 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.437 ' CZ ' ' HA ' ' A' ' 28' ' ' VAL . 8.5 m-85 -121.24 126.93 50.81 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.5 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -82.33 150.13 27.37 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.98 179.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.8 mtt-85 -87.63 143.11 33.35 Favored Pre-proline 0 N--CA 1.463 0.192 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.87 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -78.92 166.54 79.06 Favored 'Cis proline' 0 C--N 1.352 0.753 0 C-N-CA 123.661 -1.391 . . . . 0.0 112.766 0.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.5 p -146.85 139.49 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.099 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -114.65 159.79 20.07 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.681 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.475 ' CD1' HD13 ' A' ' 59' ' ' LEU . 37.6 t80 -55.53 -40.62 72.06 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.666 -0.243 . . . . 0.0 110.958 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.12 -43.43 91.94 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.009 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -63.02 -44.64 95.37 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.987 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.609 ' O ' HG23 ' A' ' 32' ' ' VAL . 41.1 t -68.0 -47.7 77.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.907 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -64.01 -44.91 91.16 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.172 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -56.4 -43.45 79.33 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.421 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.798 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.5 OUTLIER -69.35 -49.33 56.62 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.096 179.878 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.619 HG21 ' CZ ' ' A' ' 8' ' ' PHE . 47.6 t -63.13 -44.84 99.64 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.511 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 90.4 m -58.42 -39.37 79.58 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.982 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 28.5 m -72.27 -40.8 67.37 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 121.186 -0.206 . . . . 0.0 111.303 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.798 HG23 ' O ' ' A' ' 31' ' ' LYS . 58.9 t -56.83 -51.85 62.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 120.558 0.218 . . . . 0.0 111.553 -179.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.666 ' CE2' HD21 ' A' ' 79' ' ' LEU . 81.6 m-85 -90.37 -27.4 19.38 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.115 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.736 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 102.44 -160.12 17.5 Favored Glycine 0 C--N 1.336 0.536 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.577 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -144.88 158.46 52.71 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 120.446 0.165 . . . . 0.0 110.868 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -87.5 131.77 12.07 Favored 'Cis proline' 0 C--N 1.346 0.427 0 C-N-CA 123.649 -1.396 . . . . 0.0 113.055 0.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.736 HD12 ' O ' ' A' ' 37' ' ' GLY . 17.9 mt -136.71 147.71 46.92 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.089 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -114.55 130.17 56.73 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.991 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.438 HD21 HG11 ' A' ' 32' ' ' VAL . 3.5 mt -87.8 110.07 20.21 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.873 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.44 ' CD2' ' HB3' ' A' ' 50' ' ' SER . 0.1 OUTLIER -115.41 119.46 36.32 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.495 -179.67 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.796 ' HB3' HD21 ' A' ' 53' ' ' LEU . 12.7 t80 -98.59 130.44 45.13 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.867 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -101.95 131.02 48.59 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.642 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -77.99 -40.12 40.17 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.786 0.327 . . . . 0.0 110.797 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -174.48 -54.51 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.202 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.8 -41.08 3.85 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.353 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -100.36 165.94 11.21 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.995 0.426 . . . . 0.0 111.388 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.44 ' HB3' ' CD2' ' A' ' 43' ' ' HIS . 2.5 m -121.29 122.25 39.49 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.763 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.15 131.78 65.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.184 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.11 135.07 34.55 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.709 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.796 HD21 ' HB3' ' A' ' 44' ' ' TYR . 0.5 OUTLIER -98.42 86.64 3.66 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.456 179.85 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -99.55 24.57 8.04 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.672 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -166.08 160.05 16.01 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.588 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.8 -40.82 89.64 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.73 0.3 . . . . 0.0 110.394 179.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -61.94 -46.25 90.11 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.984 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -60.67 -44.33 96.6 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.882 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.475 HD13 ' CD1' ' A' ' 25' ' ' TYR . 4.7 tp -63.01 -42.96 99.97 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.111 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -69.45 -34.84 74.99 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.277 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.0 ttpt -62.39 -37.01 84.09 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.863 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.77 -37.86 89.05 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.991 179.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 33.2 mm -63.75 -43.92 98.14 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.19 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -53.9 -36.48 62.76 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.053 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.8 mt -66.63 -40.11 85.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.819 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 26.2 tp -62.39 -40.06 95.26 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.118 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.19 -34.36 68.43 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.3 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.0 -34.51 76.64 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.898 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.4 t -81.61 97.93 8.1 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.048 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.3 p -63.69 -33.76 76.36 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.404 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.8 p -71.16 -49.31 45.25 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.246 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.9 ttm -67.89 147.21 52.81 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.075 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.28 -48.34 0.59 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.31 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.41 171.11 15.57 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.706 0.289 . . . . 0.0 110.842 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.449 ' HB3' HD11 ' A' ' 77' ' ' ILE . 4.0 mm? -102.36 118.25 36.48 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.744 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -92.16 84.04 5.19 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.777 0.322 . . . . 0.0 110.93 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.449 HD11 ' HB3' ' A' ' 75' ' ' LEU . 2.9 mt -109.29 128.56 65.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.004 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.518 HD12 HD11 ' A' ' 80' ' ' LEU . 0.5 OUTLIER -113.36 123.8 50.96 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.32 -179.844 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.666 HD21 ' CE2' ' A' ' 36' ' ' PHE . 2.8 pp -112.97 131.48 55.74 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.696 179.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.518 HD11 HD12 ' A' ' 78' ' ' LEU . 1.7 mp -121.09 151.22 40.1 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.241 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . 0.473 ' HA ' HD23 ' A' ' 40' ' ' LEU . 2.5 t -98.14 147.41 24.6 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.119 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.261 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.651 179.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.504 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 14.4 p-10 . . . . . 0 C--O 1.234 0.243 0 CA-C-O 120.99 0.424 . . . . 0.0 111.205 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 32.2 t -75.77 129.63 36.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.973 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -87.81 112.06 22.05 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.78 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.418 ' HA ' ' HB2' ' A' ' 75' ' ' LEU . 19.8 mt -99.11 125.9 52.49 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.02 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.0 mttt -99.33 117.67 34.28 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.8 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.449 ' CD1' HD12 ' A' ' 17' ' ' ILE . 80.0 m-85 -107.37 145.72 32.52 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.036 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -125.9 126.1 43.87 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.13 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.0 t-160 -141.27 116.94 10.31 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.567 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 16.0 m120 57.21 34.92 25.52 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.236 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.94 -38.34 3.17 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.864 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -65.3 150.81 47.62 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.759 0.314 . . . . 0.0 111.291 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.58 157.14 37.88 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.357 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.2 142.28 24.92 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.056 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.3 mp -114.59 119.56 61.87 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.941 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.449 HD12 ' CD1' ' A' ' 8' ' ' PHE . 3.1 mt -127.12 130.79 71.16 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.038 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.504 ' HB1' ' HB2' ' A' ' 3' ' ' ASP . . . -94.11 143.42 26.38 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.434 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.403 ' CD2' HD12 ' A' ' 6' ' ' ILE . 44.8 m-85 -137.6 117.08 12.86 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.903 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.9 p -72.69 143.21 48.16 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.083 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.82 153.92 37.65 Favored Pre-proline 0 C--O 1.232 0.171 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.305 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -74.53 140.57 68.02 Favored 'Cis proline' 0 C--N 1.351 0.706 0 C-N-CA 123.54 -1.442 . . . . 0.0 112.528 0.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.9 p -127.01 143.67 39.71 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.048 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.64 142.48 27.3 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.062 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 50.3 t80 -59.58 -36.99 77.31 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.209 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.56 -45.0 89.89 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.995 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -63.05 -44.58 95.48 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.157 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.693 ' O ' HG23 ' A' ' 32' ' ' VAL . 24.9 t -67.05 -46.7 84.0 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.935 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.444 ' HG2' HD11 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -58.64 -45.2 89.81 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.169 179.916 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -56.78 -46.77 81.29 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.761 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.755 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.3 OUTLIER -67.06 -49.83 63.81 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.3 179.784 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.693 HG23 ' O ' ' A' ' 28' ' ' VAL . 47.4 t -58.48 -43.29 86.52 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.335 -179.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 95.4 m -62.8 -39.45 94.3 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.02 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 39.0 m -72.08 -42.86 65.68 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 121.254 -0.178 . . . . 0.0 111.425 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.755 HG23 ' O ' ' A' ' 31' ' ' LYS . 59.7 t -56.57 -51.91 59.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-O 120.54 0.21 . . . . 0.0 111.533 -179.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.537 ' CE2' HD21 ' A' ' 79' ' ' LEU . 76.7 m-85 -88.32 -28.21 21.18 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.303 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.66 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 101.73 -159.95 18.17 Favored Glycine 0 C--N 1.334 0.442 0 C-N-CA 121.0 -0.619 . . . . 0.0 112.347 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.76 156.15 55.98 Favored Pre-proline 0 N--CA 1.464 0.244 0 CA-C-O 120.437 0.16 . . . . 0.0 110.787 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -88.07 131.35 10.97 Favored 'Cis proline' 0 C--N 1.35 0.639 0 C-N-CA 123.559 -1.434 . . . . 0.0 112.939 0.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.66 HD12 ' O ' ' A' ' 37' ' ' GLY . 6.4 mt -138.34 130.55 28.7 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.138 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -101.64 135.2 43.56 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.019 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.444 HD11 ' HG2' ' A' ' 29' ' ' GLU . 9.3 mt -91.27 104.16 16.74 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.781 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -106.48 129.71 54.4 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.27 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -106.1 119.32 38.91 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.582 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.414 ' O ' ' HD2' ' A' ' 76' ' ' ARG . 5.3 mtt -131.76 140.01 49.11 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.933 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 -99.35 -45.98 5.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.775 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -172.95 -64.11 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.486 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -108.82 -30.83 7.95 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.464 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.3 mt -93.73 132.58 37.95 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.716 0.293 . . . . 0.0 111.227 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 94.8 p -112.1 122.58 48.15 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.798 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.0 mp -127.5 132.72 69.01 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.032 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.526 HD23 ' N ' ' A' ' 53' ' ' LEU . 1.9 tt -102.96 131.17 50.11 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.515 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.526 ' N ' HD23 ' A' ' 52' ' ' LEU . 12.1 mt -74.52 84.75 2.03 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.085 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.2 tptt -77.86 -37.61 47.89 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.977 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -145.23 -179.24 6.51 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.139 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -57.47 -35.09 69.71 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.842 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.24 -46.18 79.69 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.963 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -60.45 -41.61 94.44 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.711 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.7 tp -63.42 -43.45 97.45 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.125 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.46 -41.11 98.52 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.254 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.04 -35.75 81.27 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.684 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.96 -38.34 90.71 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.166 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.6 mm -63.89 -42.43 95.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.083 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -56.71 -39.46 73.91 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.035 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 47.6 mt -68.36 -40.48 82.47 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.046 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.717 HD11 ' HG ' ' A' ' 75' ' ' LEU . 92.8 mt -61.05 -46.9 88.82 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.061 179.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.91 -31.34 70.86 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.176 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.7 mmt180 -66.94 -28.02 67.94 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.257 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.8 t -59.75 148.49 34.08 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.872 0.367 . . . . 0.0 111.502 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.07 -35.52 71.93 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.234 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -158.36 93.25 1.2 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.996 0.427 . . . . 0.0 111.754 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -167.22 107.83 0.61 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.053 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -99.28 -31.89 11.47 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.341 179.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.87 165.03 25.7 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.744 0.307 . . . . 0.0 111.372 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.717 ' HG ' HD11 ' A' ' 66' ' ' LEU . 0.5 OUTLIER -110.27 131.66 54.86 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.281 -179.915 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.414 ' HD2' ' O ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -87.18 78.95 8.74 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.936 179.86 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.618 HD11 HD23 ' A' ' 75' ' ' LEU . 32.7 mm -104.01 113.58 41.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.607 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.55 HD21 HD21 ' A' ' 80' ' ' LEU . 6.4 tt -110.77 117.15 32.66 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.861 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.537 HD21 ' CE2' ' A' ' 36' ' ' PHE . 2.5 pp -112.33 130.61 55.9 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.874 0.368 . . . . 0.0 110.967 179.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.55 HD21 HD21 ' A' ' 78' ' ' LEU . 0.4 OUTLIER -121.64 156.94 31.93 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.204 -179.747 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 6.1 t -83.01 147.65 28.04 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.779 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 33.2 tp60 . . . . . 0 CA--C 1.532 0.286 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.915 179.738 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 . . . . . 0 N--CA 1.465 0.314 0 CA-C-O 120.981 0.419 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 25.4 t -86.18 145.04 8.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.424 -179.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -93.49 106.41 18.38 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.017 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.2 mt -104.69 125.96 59.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.071 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -103.93 129.47 51.48 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.596 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -111.83 131.55 55.27 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.859 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.445 ' HG3' ' HG3' ' A' ' 14' ' ' ARG . 24.7 tt0 -119.39 130.01 55.09 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.819 0.342 . . . . 0.0 111.116 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.7 t-160 -141.07 121.0 13.59 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.694 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 61.07 26.2 16.16 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.604 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.36 -46.96 1.14 Allowed Glycine 0 C--N 1.338 0.644 0 C-N-CA 120.912 -0.661 . . . . 0.0 113.415 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -66.02 139.58 58.22 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.925 0.362 . . . . 0.0 111.275 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.445 ' HG3' ' HG3' ' A' ' 9' ' ' GLU . 2.6 mtt85 -108.91 155.25 21.05 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.419 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.1 149.22 50.0 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.926 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.45 ' O ' HD13 ' A' ' 17' ' ' ILE . 34.3 mt -115.32 117.68 56.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.078 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.45 HD13 ' O ' ' A' ' 16' ' ' ILE . 21.2 mm -131.57 136.49 57.17 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.257 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.53 141.32 28.74 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.992 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -128.91 117.1 20.43 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.937 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 37.8 t -86.29 140.84 29.71 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.89 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -84.79 157.53 60.46 Favored Pre-proline 0 CA--C 1.531 0.25 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.025 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.75 157.48 99.52 Favored 'Cis proline' 0 C--N 1.35 0.628 0 C-N-CA 123.486 -1.464 . . . . 0.0 112.77 0.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.7 p -139.25 139.25 39.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.196 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.577 ' O ' HG23 ' A' ' 28' ' ' VAL . 9.3 mptt -119.47 154.61 33.5 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.719 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.45 ' CD1' HD11 ' A' ' 59' ' ' LEU . 23.1 t80 -54.35 -45.13 72.65 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.85 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.43 -41.94 99.09 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.16 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -62.58 -44.24 96.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.987 -179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.654 ' O ' HG23 ' A' ' 32' ' ' VAL . 20.4 t -67.7 -43.25 86.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.793 179.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.81 -45.37 86.2 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.442 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.74 -42.75 99.38 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.315 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.789 ' O ' HG23 ' A' ' 35' ' ' VAL . 7.8 tmtt? -69.92 -49.72 49.24 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.267 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.654 HG23 ' O ' ' A' ' 28' ' ' VAL . 47.6 t -61.55 -40.91 88.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 CA-C-N 116.663 -0.244 . . . . 0.0 111.476 -179.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.726 HG23 ' HG3' ' A' ' 38' ' ' GLN . 22.3 m -58.62 -41.26 85.49 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.088 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 34.8 m -72.56 -37.39 68.24 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 111.524 0.194 . . . . 0.0 111.524 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.789 HG23 ' O ' ' A' ' 31' ' ' LYS . 47.1 t -61.23 -52.7 58.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 N-CA-C 111.876 0.325 . . . . 0.0 111.876 -179.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -98.16 -15.85 19.75 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -178.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.401 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 95.14 -156.9 21.88 Favored Glycine 0 C--N 1.334 0.457 0 C-N-CA 120.598 -0.81 . . . . 0.0 112.349 -179.28 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.726 ' HG3' HG23 ' A' ' 33' ' ' THR . 0.9 OUTLIER -144.74 158.48 53.14 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.456 0.169 . . . . 0.0 111.056 179.915 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -89.61 132.48 9.74 Favored 'Cis proline' 0 C--N 1.349 0.595 0 C-N-CA 123.771 -1.345 . . . . 0.0 112.889 0.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.401 HD12 ' O ' ' A' ' 37' ' ' GLY . 29.2 mt -138.53 135.45 35.08 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.012 179.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -114.73 139.52 49.62 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.049 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.594 ' HB3' HD12 ' A' ' 53' ' ' LEU . 5.7 mt -80.81 108.89 14.86 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.945 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.8 m80 -114.0 120.42 40.58 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.116 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.592 ' CD2' HD21 ' A' ' 53' ' ' LEU . 0.5 OUTLIER -88.88 129.53 35.58 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.854 179.721 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 17.6 mtp -125.8 117.8 24.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.53 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 20.0 m-20 -79.18 -54.25 6.17 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.794 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -172.9 -61.34 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.353 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -107.46 -24.76 11.7 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.434 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.576 HD22 HD11 ' A' ' 51' ' ' ILE . 0.3 OUTLIER -110.59 149.84 29.82 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.865 0.364 . . . . 0.0 111.389 -179.681 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.53 122.36 45.46 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.001 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.576 HD11 HD22 ' A' ' 49' ' ' LEU . 28.7 mm -114.37 131.36 66.62 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.785 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.61 HD23 ' N ' ' A' ' 53' ' ' LEU . 4.7 tt -94.78 130.52 41.29 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.783 0.325 . . . . 0.0 111.024 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.61 ' N ' HD23 ' A' ' 52' ' ' LEU . 0.7 OUTLIER -81.79 95.32 7.25 Favored 'General case' 0 CA--C 1.527 0.086 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.379 179.37 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -84.71 -36.03 22.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.122 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.1 m-20 -144.67 -179.73 6.76 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.936 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.577 ' HA ' HD12 ' A' ' 59' ' ' LEU . 13.3 tp60 -58.41 -33.41 69.63 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.8 179.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -53.16 -41.65 65.38 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.201 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -64.53 -40.96 96.57 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.769 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.577 HD12 ' HA ' ' A' ' 56' ' ' GLN . 11.0 mt -65.52 -42.0 92.53 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.008 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.414 ' HA ' HD12 ' A' ' 63' ' ' ILE . 4.5 m-20 -60.93 -39.81 90.83 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.91 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -68.24 -39.48 82.27 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.642 178.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.442 ' HB1' ' CZ ' ' A' ' 44' ' ' TYR . . . -65.65 -43.67 88.68 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.558 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.414 HD12 ' HA ' ' A' ' 60' ' ' ASP . 8.2 mt -62.81 -40.97 90.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 116.701 -0.227 . . . . 0.0 110.771 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -52.86 -34.97 56.8 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.24 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 30.6 mm -66.65 -45.37 88.54 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.07 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.0 mt -66.77 -45.14 79.46 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.988 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.12 -40.16 94.96 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.004 179.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -63.21 -35.23 79.63 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.129 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.8 t -70.48 122.14 19.1 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.899 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.74 -36.01 75.73 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.222 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 32.3 p -70.64 -81.06 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.907 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.3 tmm? 64.04 160.01 0.1 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.064 0.459 . . . . 0.0 111.696 179.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.34 -59.72 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.367 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 m -155.52 174.77 14.79 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.574 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.4 mp -91.95 131.66 37.1 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.413 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -95.7 74.78 3.18 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.136 0.493 . . . . 0.0 111.199 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.46 HG12 ' CE2' ' A' ' 44' ' ' TYR . 25.6 mt -103.92 129.22 56.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.819 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.9 tt -113.38 118.25 34.03 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.103 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.3 pp -104.19 131.55 51.37 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.706 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.4 pp -118.8 159.72 23.21 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.067 0.46 . . . . 0.0 111.334 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -90.72 147.6 23.15 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.77 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 . . . . . 0 N--CA 1.465 0.313 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 179.867 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.233 0 CA-C-O 120.91 0.386 . . . . 0.0 110.302 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.616 HG23 ' HG3' ' A' ' 21' ' ' ARG . 36.2 t -79.86 125.14 38.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.868 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.3 mtm105 -94.36 106.34 18.32 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.699 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.7 mp -101.92 134.43 42.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.997 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.8 mttm -100.34 118.09 35.89 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.714 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.492 ' CD1' HD12 ' A' ' 17' ' ' ILE . 93.2 m-85 -107.39 131.88 53.78 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.146 -179.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -126.58 131.94 51.41 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.212 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 9.0 t-160 -139.49 121.08 15.2 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.529 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.0 m-20 57.25 31.64 20.41 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.221 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.11 -30.22 7.87 Favored Glycine 0 CA--C 1.524 0.609 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.937 -179.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -65.61 140.57 58.53 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.761 0.315 . . . . 0.0 111.187 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -103.69 154.97 18.95 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.32 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.2 tpp180 -151.76 144.23 24.15 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.069 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.3 mt -113.66 127.64 70.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.001 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.492 HD12 ' CD1' ' A' ' 8' ' ' PHE . 20.1 mt -138.39 125.61 27.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-O 120.784 0.326 . . . . 0.0 111.29 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -112.49 131.07 55.77 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.042 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -128.07 126.8 41.93 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.75 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.3 t -68.3 128.11 35.38 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.946 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.616 ' HG3' HG23 ' A' ' 4' ' ' VAL . 8.6 mtm180 -71.35 150.83 94.21 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.062 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -74.62 125.76 11.62 Favored 'Cis proline' 0 C--N 1.35 0.645 0 C-N-CA 123.517 -1.451 . . . . 0.0 112.308 0.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.5 p -73.58 131.91 34.19 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.04 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.504 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -96.98 127.14 42.66 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.154 -179.762 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.484 ' OH ' HD22 ' A' ' 42' ' ' LEU . 71.3 t80 -53.95 -43.72 70.1 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.076 179.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.406 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 1.4 mm-40 -60.97 -38.85 87.38 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.087 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -69.17 -44.27 72.58 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.124 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 24' ' ' LYS . 22.0 t -63.76 -47.24 91.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.019 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.406 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 11.5 pt-20 -63.91 -36.75 84.96 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.186 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -56.68 -45.22 81.87 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.583 0.23 . . . . 0.0 111.061 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.574 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.3 OUTLIER -68.89 -48.84 62.36 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.325 179.819 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 50.0 t -62.63 -40.58 88.92 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.538 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.73 HG23 ' HB3' ' A' ' 38' ' ' GLN . 79.9 m -61.01 -47.26 87.27 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.896 -0.138 . . . . 0.0 111.269 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.0 m -72.88 -44.52 61.21 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 31' ' ' LYS . 70.1 t -67.1 -44.8 87.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.235 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.575 ' HB2' HD11 ' A' ' 40' ' ' LEU . 15.9 m-85 -100.28 7.06 44.65 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.09 172.7 23.59 Favored Glycine 0 C--N 1.339 0.704 0 C-N-CA 120.503 -0.856 . . . . 0.0 112.88 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.73 ' HB3' HG23 ' A' ' 33' ' ' THR . 6.8 pt20 -135.04 154.65 79.23 Favored Pre-proline 0 C--O 1.234 0.242 0 O-C-N 122.853 -0.204 . . . . 0.0 110.98 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.43 ' HG2' ' HB3' ' A' ' 82' ' ' GLN . 95.7 Cg_endo -88.02 153.61 38.33 Favored 'Cis proline' 0 C--N 1.35 0.609 0 C-N-CA 123.567 -1.43 . . . . 0.0 113.338 0.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.575 HD11 ' HB2' ' A' ' 36' ' ' PHE . 15.7 mt -124.6 160.4 28.51 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.08 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -111.46 126.3 54.8 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.661 179.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.484 HD22 ' OH ' ' A' ' 25' ' ' TYR . 5.2 mp -90.23 96.24 10.57 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.818 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -115.22 122.98 47.66 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.284 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.537 ' HB2' HD21 ' A' ' 53' ' ' LEU . 11.7 t80 -105.79 129.4 53.99 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.691 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -131.27 120.73 23.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.731 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -85.02 -68.42 0.73 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.851 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -149.08 -74.61 0.17 Allowed 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.393 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -110.1 4.66 21.4 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.433 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.465 HD12 HD11 ' A' ' 51' ' ' ILE . 0.6 OUTLIER -130.12 140.03 50.84 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.792 0.329 . . . . 0.0 111.277 -179.917 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -115.23 128.3 56.06 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.712 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.465 HD11 HD12 ' A' ' 49' ' ' LEU . 18.8 mt -128.39 134.26 65.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.958 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 39.8 mt -93.85 132.81 37.9 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.941 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.537 HD21 ' HB2' ' A' ' 44' ' ' TYR . 0.8 OUTLIER -122.95 88.04 2.86 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.011 0.434 . . . . 0.0 111.26 179.719 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.92 -32.51 14.54 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.969 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -100.87 166.64 10.74 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.982 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -31.98 73.44 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.027 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -56.82 -50.11 73.35 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.063 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -63.09 -45.02 94.1 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.822 0.344 . . . . 0.0 110.802 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.3 tp -58.59 -45.88 88.16 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.022 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.63 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.4 OUTLIER -63.79 -42.18 97.79 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.012 179.892 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.8 tmtt? -62.34 -38.63 90.21 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.729 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.74 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -62.42 -39.88 94.75 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.54 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.63 HD12 ' HA ' ' A' ' 60' ' ' ASP . 12.7 mt -63.57 -43.73 98.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-O 120.606 0.241 . . . . 0.0 110.881 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -56.17 -39.5 72.43 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.11 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.74 HD12 ' HA ' ' A' ' 62' ' ' ALA . 12.4 mt -64.03 -45.03 97.83 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.907 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.638 HD13 HD12 ' A' ' 75' ' ' LEU . 5.5 tt -61.85 -47.35 85.45 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.673 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -58.6 -40.31 82.89 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.076 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -33.14 74.02 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.384 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 33.6 t -83.2 119.97 25.22 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.754 0.311 . . . . 0.0 111.208 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.4 p -68.0 -35.37 78.21 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.921 179.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.99 -37.08 67.13 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.402 -179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.45 ' SD ' HD12 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -80.89 109.0 15.03 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.711 0.291 . . . . 0.0 111.132 -179.844 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.77 -31.99 7.24 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.784 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.2 m -122.15 154.35 37.54 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.656 0.265 . . . . 0.0 110.948 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.638 HD12 HD13 ' A' ' 66' ' ' LEU . 1.1 mp -92.74 117.35 29.91 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.174 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.74 86.1 3.99 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.384 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.9 mt -102.26 131.79 49.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.681 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 41.8 tp -102.12 117.25 34.38 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.755 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.7 pp -104.87 126.95 52.48 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.865 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.8 mp -119.2 122.74 42.67 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.849 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . 0.526 ' HA ' HD23 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -74.75 142.84 44.3 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.153 -179.89 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . 0.43 ' HB3' ' HG2' ' A' ' 39' ' ' PRO . 0.3 OUTLIER . . . . . 0 N--CA 1.464 0.26 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.904 179.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 p30 . . . . . 0 N--CA 1.464 0.271 0 CA-C-O 120.875 0.369 . . . . 0.0 111.403 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.445 HG12 HD21 ' A' ' 75' ' ' LEU . 17.6 t -150.09 128.26 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.993 179.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -97.09 116.27 29.0 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.637 0.256 . . . . 0.0 110.963 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.735 HG12 HD11 ' A' ' 75' ' ' LEU . 21.7 mt -107.52 118.16 54.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.183 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.492 ' CD ' ' HB3' ' A' ' 74' ' ' SER . 0.0 OUTLIER -95.03 109.59 21.61 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.71 179.786 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -104.28 142.25 34.86 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.154 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -134.47 124.24 25.28 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.886 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -142.28 121.21 12.8 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.699 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 62.1 t30 57.16 34.0 24.18 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.88 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 91.02 -32.23 5.25 Favored Glycine 0 C--N 1.337 0.622 0 C-N-CA 121.047 -0.596 . . . . 0.0 113.075 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.35 136.86 55.47 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.836 0.35 . . . . 0.0 111.247 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -114.19 142.6 46.04 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.946 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.8 mtm-85 -134.11 140.49 46.63 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.172 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.461 HD12 ' HE2' ' A' ' 7' ' ' LYS . 25.9 mm -114.1 117.44 55.52 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.003 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.1 mt -125.78 137.89 56.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.215 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -110.54 133.94 52.84 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.172 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -125.4 122.83 37.86 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.196 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.88 158.49 19.31 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.042 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.05 154.95 40.58 Favored Pre-proline 0 CA--C 1.531 0.245 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.955 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -76.7 126.6 13.55 Favored 'Cis proline' 0 C--N 1.351 0.71 0 C-N-CA 123.396 -1.502 . . . . 0.0 112.737 -0.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.5 p -90.07 146.82 5.72 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.335 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.652 ' O ' HG23 ' A' ' 28' ' ' VAL . 4.5 mtpt -120.82 143.66 48.75 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.098 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 24.3 t80 -54.79 -52.97 60.98 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.077 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.445 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 0.3 OUTLIER -61.1 -34.82 75.55 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.163 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.33 -43.54 77.29 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.139 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.668 ' O ' HG23 ' A' ' 32' ' ' VAL . 43.5 t -63.18 -47.63 91.44 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.126 0 CA-C-N 116.693 -0.231 . . . . 0.0 111.146 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.445 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 9.3 pt-20 -64.49 -37.9 89.13 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.276 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -49.03 76.55 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.722 -0.217 . . . . 0.0 110.892 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.66 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.1 OUTLIER -67.74 -48.96 64.98 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.278 179.861 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.668 HG23 ' O ' ' A' ' 28' ' ' VAL . 43.0 t -59.17 -41.44 83.73 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 116.678 -0.237 . . . . 0.0 111.358 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 99.4 m -65.01 -41.45 95.32 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.908 -0.133 . . . . 0.0 111.042 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.9 m -72.76 -43.71 62.53 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 121.108 -0.237 . . . . 0.0 111.617 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' ' 31' ' ' LYS . 48.5 t -66.47 -49.67 73.41 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 N-CA-C 111.574 0.213 . . . . 0.0 111.574 -179.411 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -88.71 -10.72 47.41 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -179.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.5 ' O ' HD13 ' A' ' 40' ' ' LEU . . . 91.21 -176.89 40.8 Favored Glycine 0 C--N 1.338 0.65 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.575 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.416 ' HA ' HD12 ' A' ' 40' ' ' LEU . 1.0 OUTLIER -145.19 156.31 54.35 Favored Pre-proline 0 N--CA 1.465 0.285 0 CA-C-O 120.528 0.204 . . . . 0.0 110.83 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.527 ' C ' HD12 ' A' ' 40' ' ' LEU . 92.0 Cg_endo -93.25 128.22 5.12 Favored 'Cis proline' 0 C--N 1.351 0.699 0 C-N-CA 123.918 -1.284 . . . . 0.0 112.933 0.099 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.801 HD23 HD13 ' A' ' 79' ' ' LEU . 6.3 mp -134.57 139.98 45.78 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.992 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.66 139.47 38.2 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.137 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.576 HD21 HG11 ' A' ' 32' ' ' VAL . 0.8 OUTLIER -91.06 106.47 18.54 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.213 -179.8 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -101.65 118.98 38.05 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.251 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.418 ' OH ' ' HB1' ' A' ' 62' ' ' ALA . 2.2 t80 -88.95 118.5 28.72 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.822 179.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.684 ' HB2' HD21 ' A' ' 78' ' ' LEU . 0.9 OUTLIER -130.63 116.16 17.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.764 179.891 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -80.85 -50.35 9.9 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.791 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.45 -63.7 0.02 OUTLIER 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.61 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.6 mp0 -109.54 -24.12 11.15 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.726 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.7 mp -103.4 138.83 39.6 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.79 0.328 . . . . 0.0 111.317 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 87.2 p -114.32 121.62 44.19 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.87 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.5 mp -124.44 134.28 67.12 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.712 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 14.6 tp -98.96 124.91 44.23 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.771 -0.195 . . . . 0.0 110.705 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.486 HD22 HD23 ' A' ' 59' ' ' LEU . 1.5 mt -65.0 103.42 0.73 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.912 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.1 mtmm -103.1 -31.78 9.99 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.703 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -148.08 173.85 12.52 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.779 0.323 . . . . 0.0 111.465 -179.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.468 ' HA ' HD12 ' A' ' 59' ' ' LEU . 1.3 mt-30 -56.94 -29.72 63.4 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.138 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -53.08 -41.74 65.19 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.036 179.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -68.39 -40.67 81.28 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.761 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.486 HD23 HD22 ' A' ' 53' ' ' LEU . 36.5 mt -63.52 -40.28 96.62 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.526 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.87 ' HA ' HD12 ' A' ' 63' ' ' ILE . 1.2 t0 -67.22 -37.62 83.9 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.163 179.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.47 -36.69 83.28 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.769 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.418 ' HB1' ' OH ' ' A' ' 44' ' ' TYR . . . -62.84 -37.71 87.86 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.185 179.344 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.87 HD12 ' HA ' ' A' ' 60' ' ' ASP . 11.1 mt -63.84 -44.29 98.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.951 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.03 -39.34 69.02 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.063 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 29.5 mt -66.79 -42.97 90.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.015 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 40.4 mt -67.45 -46.41 73.15 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.139 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -60.98 -38.94 87.76 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.369 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -65.69 -32.68 74.37 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.427 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 33.8 t -109.26 93.59 4.59 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.959 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.8 m -59.48 -27.28 65.98 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.765 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.0 t -57.67 -35.39 70.5 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.542 0.21 . . . . 0.0 111.282 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -117.21 163.17 16.7 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.762 0.315 . . . . 0.0 111.251 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -162.24 36.56 0.12 Allowed 'General case' 0 C--O 1.235 0.342 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.265 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.492 ' HB3' ' CD ' ' A' ' 7' ' ' LYS . 0.9 OUTLIER -143.18 149.11 37.57 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.708 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.735 HD11 HG12 ' A' ' 6' ' ' ILE . 0.1 OUTLIER -111.58 132.92 54.2 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.855 179.78 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.81 119.45 36.43 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.956 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.436 HD11 HD12 ' A' ' 75' ' ' LEU . 16.0 mt -128.45 118.33 47.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.873 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.684 HD21 ' HB2' ' A' ' 45' ' ' MET . 0.4 OUTLIER -106.3 122.17 45.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.955 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.801 HD13 HD23 ' A' ' 40' ' ' LEU . 3.0 pp -114.36 135.85 53.63 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.691 179.689 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.485 ' N ' HD12 ' A' ' 80' ' ' LEU . 3.0 mp -114.3 144.35 43.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.792 -179.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -98.84 136.55 38.7 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.008 0.433 . . . . 0.0 110.999 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.278 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.123 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 . . . . . 0 C--O 1.234 0.25 0 CA-C-O 120.889 0.376 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.2 t -131.34 129.0 62.11 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.966 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.443 ' NH1' HG22 ' A' ' 16' ' ' ILE . 5.8 mtt-85 -88.5 112.72 23.31 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.952 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.555 HD12 ' HD2' ' A' ' 19' ' ' PHE . 6.2 mt -106.33 128.65 60.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.956 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.5 mtpt -104.04 125.23 50.23 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.586 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.502 ' CE1' HD12 ' A' ' 17' ' ' ILE . 20.6 m-85 -109.21 144.54 37.18 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.213 -179.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -121.77 124.0 43.16 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.294 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . 0.676 ' HB2' HD11 ' A' ' 79' ' ' LEU . 12.1 t-160 -141.2 115.83 9.6 Favored 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.438 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 56.8 m-20 58.21 30.9 20.1 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 120.818 0.342 . . . . 0.0 111.137 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.9 -2.79 87.7 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 121.105 -0.569 . . . . 0.0 113.296 -179.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -85.64 143.08 28.63 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 117.216 0.508 . . . . 0.0 110.886 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.01 137.74 43.41 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.12 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -133.94 133.78 41.8 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.788 179.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.443 HG22 ' NH1' ' A' ' 5' ' ' ARG . 3.4 mp -114.07 117.29 55.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.073 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.502 HD12 ' CE1' ' A' ' 8' ' ' PHE . 10.9 mt -129.38 131.36 67.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.157 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -102.81 145.41 29.8 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.136 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.555 ' HD2' HD12 ' A' ' 6' ' ' ILE . 46.2 m-85 -138.84 116.9 11.71 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.031 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.4 p -78.98 135.84 37.04 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.031 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.1 mtt180 -74.87 152.81 86.87 Favored Pre-proline 0 CA--C 1.531 0.243 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.844 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -72.79 129.04 16.46 Favored 'Cis proline' 0 C--N 1.35 0.611 0 C-N-CA 123.763 -1.349 . . . . 0.0 112.426 0.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.431 ' O ' HG13 ' A' ' 23' ' ' VAL . 15.0 p -99.94 118.8 47.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.163 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.495 ' O ' HG23 ' A' ' 28' ' ' VAL . 11.0 mmmt -91.32 132.44 36.17 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.979 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.52 ' CD2' HD22 ' A' ' 59' ' ' LEU . 38.6 t80 -54.44 -41.64 69.64 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.704 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -59.32 -45.32 91.64 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.051 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.69 -44.63 85.59 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.121 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.677 ' O ' HG23 ' A' ' 32' ' ' VAL . 38.9 t -62.91 -47.94 90.39 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.918 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -60.78 -41.61 95.91 Favored 'General case' 0 N--CA 1.461 0.1 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.936 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -57.23 -48.43 78.85 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.119 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.692 ' O ' HG23 ' A' ' 35' ' ' VAL . 4.9 tttt -68.62 -49.5 58.71 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.257 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.677 HG23 ' O ' ' A' ' 28' ' ' VAL . 45.6 t -58.4 -44.67 89.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 CA-C-N 116.814 -0.176 . . . . 0.0 111.295 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 91.1 m -66.79 -39.38 87.76 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.192 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.4 m -72.15 -43.24 64.94 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.692 HG23 ' O ' ' A' ' 31' ' ' LYS . 60.6 t -64.92 -51.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-O 120.463 0.173 . . . . 0.0 111.246 -179.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -83.67 -20.37 33.67 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -179.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.525 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 100.08 -179.77 29.95 Favored Glycine 0 C--N 1.338 0.656 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.521 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -139.55 156.36 71.39 Favored Pre-proline 0 N--CA 1.464 0.26 0 O-C-N 122.73 -0.276 . . . . 0.0 111.175 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.41 ' HG2' ' HB2' ' A' ' 82' ' ' GLN . 95.2 Cg_endo -85.75 137.04 21.62 Favored 'Cis proline' 0 C--N 1.35 0.621 0 C-N-CA 123.438 -1.484 . . . . 0.0 112.897 0.091 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.525 HD12 ' O ' ' A' ' 37' ' ' GLY . 47.4 mt -137.9 130.07 28.96 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.515 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -103.68 138.78 39.84 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.9 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.579 HD21 HG11 ' A' ' 32' ' ' VAL . 4.2 mt -95.62 110.4 22.51 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.786 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -111.09 126.71 55.12 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.954 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.469 ' HD2' HD22 ' A' ' 53' ' ' LEU . 0.5 OUTLIER -89.14 126.33 35.42 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.722 179.736 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -131.2 118.55 20.59 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.617 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -83.61 -58.99 2.58 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.675 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -175.31 -52.29 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.544 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -109.37 -30.6 7.89 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.542 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.9 mp -112.41 154.77 25.27 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.788 0.328 . . . . 0.0 111.222 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -121.27 126.78 50.4 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.91 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 28.3 mm -113.75 134.44 56.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.859 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -96.59 126.7 41.95 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.792 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.614 HD13 HD13 ' A' ' 59' ' ' LEU . 0.5 OUTLIER -99.37 87.33 3.59 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 121.045 0.45 . . . . 0.0 110.835 179.939 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.3 mtpp -105.03 -34.2 8.06 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.138 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -103.92 163.49 12.33 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 120.78 0.324 . . . . 0.0 110.973 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.1 tm0? -63.34 -37.95 89.25 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.799 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.55 -38.54 84.82 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.206 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.62 -49.92 75.57 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.04 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.614 HD13 HD13 ' A' ' 53' ' ' LEU . 13.0 tp -63.89 -40.94 97.68 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.93 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.561 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.4 OUTLIER -67.06 -37.62 84.35 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.213 179.726 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -62.66 -39.35 93.63 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.665 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.75 -38.27 90.47 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.088 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.619 ' HA ' HD12 ' A' ' 66' ' ' LEU . 25.2 mt -65.49 -41.9 92.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.141 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.45 -39.59 67.57 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.037 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 45.1 mt -64.7 -38.37 82.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.949 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.728 HD11 ' HG ' ' A' ' 75' ' ' LEU . 15.9 mt -64.17 -45.37 88.73 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.828 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.86 -32.63 69.62 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.302 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.1 mtt-85 -66.09 -31.81 72.9 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.119 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.5 t -104.02 112.07 24.9 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.241 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.71 -33.4 71.57 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.461 179.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.8 p -72.79 -71.08 0.31 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.432 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.74 106.32 6.24 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 120.842 0.353 . . . . 0.0 111.384 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 25.1 pttt -114.74 -35.84 4.71 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.483 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.87 170.3 11.4 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 120.714 0.292 . . . . 0.0 111.526 -179.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.728 ' HG ' HD11 ' A' ' 66' ' ' LEU . 6.2 mp -114.9 133.5 55.93 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.399 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -102.6 81.45 2.03 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.517 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.5 mt -106.42 129.64 59.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.016 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.2 pp -109.03 132.65 53.91 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.023 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.676 HD11 ' HB2' ' A' ' 10' ' ' HIS . 3.1 pp -111.15 135.9 50.99 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.634 179.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.6 mt -112.57 146.9 37.73 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.168 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.5 t -94.57 147.89 22.81 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.811 179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . 0.41 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 1.7 mm-40 . . . . . 0 N--CA 1.467 0.376 0 N-CA-C 112.378 0.511 . . . . 0.0 112.378 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 . . . . . 0 N--CA 1.466 0.37 0 CA-C-O 120.676 0.274 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.657 HG21 ' NH2' ' A' ' 21' ' ' ARG . 21.3 t -134.37 146.78 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.616 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -93.67 133.08 37.4 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.981 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.483 HD12 ' CD1' ' A' ' 19' ' ' PHE . 29.7 mt -114.76 136.4 51.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.918 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.7 mttt -108.25 122.39 46.84 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.753 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -116.66 139.89 50.02 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.873 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.649 ' HB2' HD12 ' A' ' 78' ' ' LEU . 0.3 OUTLIER -119.34 131.37 55.71 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.1 -179.826 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.6 t-160 -136.01 114.7 11.96 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.658 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 57.72 35.14 25.28 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.218 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 95.23 -35.22 4.38 Favored Glycine 0 C--N 1.337 0.635 0 C-N-CA 120.915 -0.66 . . . . 0.0 113.005 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.39 150.47 48.24 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.611 0.243 . . . . 0.0 111.135 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -118.37 141.01 48.97 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.221 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 91.9 mtt-85 -129.14 147.77 51.02 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.1 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 19.2 mt -115.03 126.45 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.087 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 9.2 tp -140.22 135.31 36.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.278 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -101.85 141.19 35.08 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.14 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.483 ' CD1' HD12 ' A' ' 6' ' ' ILE . 9.5 m-85 -126.52 153.05 45.69 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.119 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 47.5 t -95.31 142.84 27.24 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.19 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.657 ' NH2' HG21 ' A' ' 4' ' ' VAL . 0.2 OUTLIER -97.12 140.85 22.31 Favored Pre-proline 0 CA--C 1.53 0.208 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.633 179.627 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.409 ' HA ' ' CG ' ' A' ' 21' ' ' ARG . 4.0 Cg_exo -74.6 143.89 79.24 Favored 'Cis proline' 0 C--N 1.351 0.695 0 C-N-CA 123.78 -1.342 . . . . 0.0 112.676 0.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.0 p -105.99 133.79 49.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.908 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.522 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -97.9 142.71 29.3 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.924 -179.664 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -60.34 -43.7 96.2 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.979 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -60.05 -41.88 93.29 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.951 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.95 -44.48 92.68 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.328 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.695 ' O ' HG23 ' A' ' 32' ' ' VAL . 33.4 t -67.28 -47.47 81.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.78 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -57.87 -45.78 85.82 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.161 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -56.87 -47.3 80.75 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.102 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.716 ' O ' HG23 ' A' ' 35' ' ' VAL . 25.9 tttt -67.09 -49.57 64.54 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.17 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.695 HG23 ' O ' ' A' ' 28' ' ' VAL . 47.9 t -58.26 -44.76 88.76 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.344 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 87.7 m -61.2 -40.42 93.88 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.151 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 20.5 m -72.54 -42.93 64.19 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 111.525 0.194 . . . . 0.0 111.525 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.716 HG23 ' O ' ' A' ' 31' ' ' LYS . 62.1 t -62.54 -52.23 62.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -87.09 -18.77 29.73 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -179.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 98.11 179.66 32.78 Favored Glycine 0 C--N 1.337 0.622 0 C-N-CA 120.65 -0.785 . . . . 0.0 112.612 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.3 pm0 -140.36 154.14 69.38 Favored Pre-proline 0 N--CA 1.465 0.315 0 O-C-N 122.863 -0.198 . . . . 0.0 110.927 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -83.3 143.87 48.6 Favored 'Cis proline' 0 C--N 1.35 0.618 0 C-N-CA 123.525 -1.448 . . . . 0.0 113.033 0.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.744 HD13 HD13 ' A' ' 79' ' ' LEU . 17.8 mt -138.52 138.93 38.5 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.155 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -104.83 119.44 39.01 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.987 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.84 113.63 22.14 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.943 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -114.08 119.52 37.41 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.135 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -101.85 129.76 48.15 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.694 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.66 133.33 55.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.785 179.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -83.32 -59.65 2.39 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.521 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -149.97 -65.11 0.21 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.408 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.481 ' O ' HD22 ' A' ' 49' ' ' LEU . 3.2 mp0 -123.21 10.74 9.35 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.54 179.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.481 HD22 ' O ' ' A' ' 48' ' ' GLU . 3.9 mm? -126.75 164.77 20.6 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.625 0.25 . . . . 0.0 111.114 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -121.06 118.43 29.77 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.888 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 22.3 mt -120.17 133.06 68.12 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.991 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.31 122.75 45.45 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.86 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.52 91.82 6.97 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.722 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.8 -32.17 16.2 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.397 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -116.1 162.33 17.58 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.758 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -62.31 -31.36 71.97 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.991 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -53.45 -46.0 69.72 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.771 0.319 . . . . 0.0 110.815 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.38 -37.36 87.22 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.299 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.65 HD13 ' C ' ' A' ' 59' ' ' LEU . 1.2 tm? -61.24 -47.14 87.41 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.482 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.425 ' N ' HD13 ' A' ' 59' ' ' LEU . 31.4 t70 -68.39 -32.15 72.02 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.151 179.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.0 tttm -62.64 -38.44 90.28 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.765 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.602 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -65.76 -36.11 82.62 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.069 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 36.4 mm -59.36 -47.78 89.38 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.836 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -55.49 -42.61 74.65 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.917 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.602 HD12 ' HA ' ' A' ' 62' ' ' ALA . 9.9 mt -67.73 -43.09 86.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.141 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.959 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 13.9 tp -58.74 -45.57 89.37 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.83 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -65.83 -32.65 74.29 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.18 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.6 mmt180 -64.69 -33.51 76.13 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.32 179.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 42.2 t -103.36 111.25 23.58 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.184 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 51.6 p -62.49 -39.97 95.19 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.968 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 32.8 p -61.14 -34.65 75.34 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.435 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.5 ttp -90.89 92.52 8.81 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.715 0.293 . . . . 0.0 110.99 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -97.86 -34.63 10.78 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.169 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.2 m -92.2 166.71 12.49 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.838 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.8 mt -97.53 120.72 38.42 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.964 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -89.66 84.51 6.32 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.684 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 15.2 mt -117.72 124.14 72.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.126 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.649 HD12 ' HB2' ' A' ' 9' ' ' GLU . 1.3 tp -111.38 117.37 32.91 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.813 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.744 HD13 HD13 ' A' ' 40' ' ' LEU . 3.3 pp -103.3 136.18 43.56 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.847 0.356 . . . . 0.0 111.158 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.7 mp -119.26 158.13 26.66 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.156 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . 0.635 ' HA ' HD23 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -88.91 137.1 32.62 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.076 179.839 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 48.4 tp60 . . . . . 0 N--CA 1.466 0.361 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.806 179.603 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.467 0.421 0 CA-C-O 120.686 0.279 . . . . 0.0 111.407 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.7 t -140.16 127.38 23.62 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.003 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.1 120.08 28.0 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.917 0.389 . . . . 0.0 111.172 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.831 HG23 HD12 ' A' ' 77' ' ' ILE . 30.2 mm -106.27 117.7 52.52 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.055 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.0 mttt -101.87 111.56 23.86 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.541 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.467 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 1.8 p90 -117.0 142.58 46.77 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.179 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -122.39 140.07 53.12 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.444 -179.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.2 t-160 -140.94 113.39 8.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.439 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.2 m120 59.76 31.42 20.81 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.541 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 104.18 -43.95 1.57 Allowed Glycine 0 C--N 1.335 0.505 0 C-N-CA 120.847 -0.692 . . . . 0.0 113.223 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -70.96 135.85 48.14 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.762 0.281 . . . . 0.0 111.119 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -119.24 156.73 29.39 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.787 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.467 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 1.1 tpt180 -141.39 143.74 34.11 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.285 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.412 ' O ' HD13 ' A' ' 17' ' ' ILE . 2.4 mt -116.9 118.93 60.44 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.054 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.412 HD13 ' O ' ' A' ' 16' ' ' ILE . 27.4 mm -129.95 137.58 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-O 120.746 0.308 . . . . 0.0 111.262 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.09 145.95 24.62 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.228 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.479 ' CZ ' HG13 ' A' ' 28' ' ' VAL . 33.8 m-85 -133.37 117.88 17.79 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.166 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 65.7 m -72.95 136.13 45.13 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.243 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 44.1 mtm180 -100.45 156.83 34.77 Favored Pre-proline 0 CA--C 1.53 0.182 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.006 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.18 122.28 8.11 Favored 'Cis proline' 0 C--N 1.35 0.654 0 C-N-CA 123.258 -1.559 . . . . 0.0 112.657 0.059 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.7 p -104.36 153.23 6.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.168 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -104.81 137.02 43.23 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.685 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -54.88 -37.06 65.81 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.67 179.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -58.52 -45.1 89.52 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.002 179.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -67.33 -44.66 78.55 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.161 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.479 HG13 ' CZ ' ' A' ' 19' ' ' PHE . 30.0 t -62.34 -47.32 93.59 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.127 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.85 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.27 -44.25 95.48 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.906 179.583 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -56.8 -40.92 76.83 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.098 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.791 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.3 OUTLIER -67.64 -49.47 62.77 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.167 179.772 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 28' ' ' VAL . 25.5 t -64.79 -41.29 91.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.373 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 96.5 m -60.17 -39.52 86.71 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.158 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 16.5 m -71.89 -29.09 63.97 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 121.238 -0.185 . . . . 0.0 111.344 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 31' ' ' LYS . 44.8 t -69.37 -53.67 23.87 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-O 120.583 0.23 . . . . 0.0 111.449 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -94.18 -11.22 30.83 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -178.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.602 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 101.92 177.39 28.04 Favored Glycine 0 C--N 1.335 0.504 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.646 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -129.46 153.89 80.68 Favored Pre-proline 0 C--O 1.233 0.227 0 CA-C-O 120.623 0.249 . . . . 0.0 111.18 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -89.12 136.1 12.6 Favored 'Cis proline' 0 C--N 1.349 0.582 0 C-N-CA 123.494 -1.461 . . . . 0.0 112.919 0.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.712 HD23 ' HA ' ' A' ' 81' ' ' SER . 55.3 mt -138.03 136.14 36.58 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.722 179.601 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -115.19 140.55 48.99 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.051 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 mp -81.74 112.31 18.79 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.508 179.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -101.36 129.86 47.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.855 ' HB2' HD21 ' A' ' 53' ' ' LEU . 0.9 OUTLIER -88.88 124.42 34.19 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-O 120.742 0.306 . . . . 0.0 111.32 -179.878 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 4.6 tpp -126.23 107.74 10.64 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.771 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.2 m-20 -78.91 -60.81 2.23 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.863 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -154.92 -59.07 0.11 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.573 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.43 11.78 6.38 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.553 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -131.59 152.49 50.75 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.648 0.261 . . . . 0.0 111.428 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 t -120.18 126.64 51.16 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.924 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.424 ' HB ' ' HB3' ' A' ' 44' ' ' TYR . 3.4 mt -114.1 134.33 57.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.855 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -93.84 126.78 39.23 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.85 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.855 HD21 ' HB2' ' A' ' 44' ' ' TYR . 1.3 mm? -100.54 96.77 7.6 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.033 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.4 tttm -93.98 -32.92 13.64 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.277 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.0 m-20 -136.99 173.2 11.95 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.754 0.311 . . . . 0.0 111.14 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -60.25 -29.81 69.02 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.958 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -53.65 -43.94 69.18 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.093 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -66.88 -38.37 86.17 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.645 179.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.44 -45.32 91.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.162 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.72 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.5 OUTLIER -62.14 -41.32 98.16 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.194 -179.837 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -62.32 -38.82 90.89 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.65 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.406 ' HB1' ' CZ ' ' A' ' 44' ' ' TYR . . . -63.6 -41.32 98.34 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.584 179.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.72 HD12 ' HA ' ' A' ' 60' ' ' ASP . 8.2 mt -63.55 -44.63 98.73 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-O 120.66 0.267 . . . . 0.0 110.762 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.39 -42.3 77.7 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.174 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.1 mt -68.02 -42.41 85.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.087 179.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 10.0 tp -59.62 -46.21 89.67 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.976 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.37 -35.62 70.21 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.24 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.62 -31.74 63.7 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.098 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.7 t -64.76 141.42 58.78 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.439 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.5 t -70.3 -30.73 67.8 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.772 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 47.7 p -92.7 37.11 1.01 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.881 0.372 . . . . 0.0 111.484 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -72.0 140.76 49.24 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.977 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -179.04 -43.3 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.073 179.677 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 64.1 m -147.14 178.06 8.68 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.798 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.451 HD13 HD13 ' A' ' 6' ' ' ILE . 6.7 mp -106.72 119.36 39.12 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.89 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.0 ttp180 -82.56 77.94 9.26 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.995 0.426 . . . . 0.0 110.608 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.831 HD12 HG23 ' A' ' 6' ' ' ILE . 22.1 mt -104.4 118.58 51.89 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.883 -179.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.648 HD23 HD11 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -102.2 127.42 49.14 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.048 -179.879 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.559 ' O ' HD12 ' A' ' 79' ' ' LEU . 3.3 pp -111.15 131.13 55.35 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.046 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.648 HD11 HD23 ' A' ' 78' ' ' LEU . 1.7 mp -140.87 151.15 44.08 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.873 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . 0.712 ' HA ' HD23 ' A' ' 40' ' ' LEU . 0.4 OUTLIER -67.79 132.7 47.9 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.993 179.92 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.284 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.288 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.6 t70 . . . . . 0 N--CA 1.464 0.244 0 CA-C-O 120.98 0.419 . . . . 0.0 111.053 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.4 t -81.0 125.02 39.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.016 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.11 115.47 29.09 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.604 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.468 ' N ' HD12 ' A' ' 6' ' ' ILE . 3.8 mp -110.1 134.05 53.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.059 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.64 114.95 29.08 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.679 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.604 ' HB3' HD21 ' A' ' 79' ' ' LEU . 61.2 m-85 -103.2 127.03 50.64 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.775 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -120.33 124.05 44.61 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.916 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.8 t-160 -139.27 116.23 10.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.547 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.27 31.7 21.38 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.174 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.66 -28.79 9.42 Favored Glycine 0 C--N 1.339 0.695 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.867 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -65.03 137.4 57.68 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.796 0.331 . . . . 0.0 111.098 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -110.23 136.05 50.04 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.014 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.1 mtp180 -130.03 136.49 49.45 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.96 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.5 mp -114.38 117.4 55.46 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.873 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.407 HD12 ' CD2' ' A' ' 8' ' ' PHE . 19.9 mt -131.87 137.06 55.78 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 CA-C-O 120.828 0.347 . . . . 0.0 111.27 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -101.67 132.54 47.31 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.079 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.456 ' HD2' HD13 ' A' ' 6' ' ' ILE . 24.3 m-85 -124.96 126.48 45.54 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.977 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.1 m -72.78 153.89 40.9 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.375 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.5 mtt180 -95.48 146.98 32.27 Favored Pre-proline 0 CA--C 1.53 0.208 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.166 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -78.24 124.08 10.25 Favored 'Cis proline' 0 C--N 1.349 0.569 0 C-N-CA 123.313 -1.536 . . . . 0.0 112.49 -0.052 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.0 p -69.34 126.88 30.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.99 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.567 ' O ' HG23 ' A' ' 28' ' ' VAL . 23.1 mmmt -102.18 147.69 26.33 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.029 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.527 ' CZ ' HD12 ' A' ' 42' ' ' LEU . 33.4 t80 -60.42 -40.18 90.09 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.65 179.446 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -62.23 -44.71 95.94 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.246 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.85 -44.35 96.37 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.189 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.568 ' O ' HG23 ' A' ' 32' ' ' VAL . 35.9 t -65.86 -46.92 87.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.479 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -63.11 -42.15 99.5 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.266 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -56.2 -43.07 78.15 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.56 0.219 . . . . 0.0 111.471 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.687 ' O ' HG23 ' A' ' 35' ' ' VAL . 4.1 mttp -70.38 -49.7 46.36 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.183 179.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 28' ' ' VAL . 38.6 t -62.4 -40.98 90.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.463 -179.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.791 HG23 ' HB3' ' A' ' 38' ' ' GLN . 52.4 m -61.8 -43.02 99.68 Favored 'General case' 0 C--O 1.226 -0.182 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.194 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 40.1 m -72.44 -44.18 62.76 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 111.533 0.197 . . . . 0.0 111.533 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.687 HG23 ' O ' ' A' ' 31' ' ' LYS . 65.2 t -63.53 -48.43 86.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.229 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.44 ' HB2' ' CD1' ' A' ' 40' ' ' LEU . 68.7 m-85 -102.37 10.12 39.3 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -178.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.26 173.41 16.03 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.775 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.791 ' HB3' HG23 ' A' ' 33' ' ' THR . 0.0 OUTLIER -127.86 157.96 71.99 Favored Pre-proline 0 N--CA 1.464 0.229 0 O-C-N 122.814 -0.227 . . . . 0.0 110.763 179.93 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -89.34 153.3 30.54 Favored 'Cis proline' 0 C--N 1.35 0.611 0 C-N-CA 123.803 -1.332 . . . . 0.0 113.351 0.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.524 HD23 ' HA ' ' A' ' 81' ' ' SER . 51.9 mt -138.32 159.17 42.74 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.134 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -114.16 134.88 54.6 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.706 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.527 HD12 ' CZ ' ' A' ' 25' ' ' TYR . 50.7 mt -92.59 107.15 19.0 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.739 0.304 . . . . 0.0 110.834 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -113.78 129.58 56.56 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.279 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.562 ' HB2' HD11 ' A' ' 53' ' ' LEU . 14.8 t80 -108.27 124.3 50.11 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.477 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.0 ptm -126.18 130.83 51.77 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.855 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -89.92 -71.45 0.61 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.165 -179.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -142.13 -71.89 0.33 Allowed 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.553 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -117.53 16.73 14.61 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.128 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.1 mt -131.59 143.74 50.56 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.611 0.244 . . . . 0.0 110.924 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.67 126.61 54.69 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.93 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.403 HD13 ' CD1' ' A' ' 44' ' ' TYR . 3.8 mp -122.75 132.73 70.73 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.109 -179.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.1 tt -102.69 135.66 43.93 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.798 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.562 HD11 ' HB2' ' A' ' 44' ' ' TYR . 0.6 OUTLIER -109.13 110.22 21.41 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.914 -179.938 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.56 -36.14 9.28 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.23 179.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -129.72 174.06 10.05 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.07 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -56.61 -33.86 66.67 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.028 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -54.44 -46.06 73.17 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 123.277 0.36 . . . . 0.0 110.956 179.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -61.92 -43.9 97.88 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.804 179.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 22.9 tp -69.01 -37.95 78.98 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.377 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.541 ' HA ' HD12 ' A' ' 63' ' ' ILE . 1.2 t70 -61.74 -43.09 99.53 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.935 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.58 -33.72 75.59 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.971 179.466 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.552 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -62.55 -35.63 80.08 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.402 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.541 HD12 ' HA ' ' A' ' 60' ' ' ASP . 13.4 mt -65.93 -44.91 92.33 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 CA-C-O 120.642 0.258 . . . . 0.0 110.468 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -41.63 89.14 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.948 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.552 HD12 ' HA ' ' A' ' 62' ' ' ALA . 11.0 mt -67.6 -41.68 85.92 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.111 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.423 HD13 ' HG ' ' A' ' 75' ' ' LEU . 1.9 tp -59.98 -47.32 86.29 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.85 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -67.63 -36.74 81.36 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.79 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 -66.21 -27.54 68.06 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.577 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 32.6 t -58.77 147.43 33.36 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.93 0.395 . . . . 0.0 111.629 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.6 p -71.33 -31.1 66.99 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.35 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.4 t -144.28 85.85 1.81 Allowed 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.955 0.407 . . . . 0.0 110.862 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 6.6 ttt -171.07 100.87 0.21 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.09 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.13 -35.1 10.12 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.234 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.405 ' C ' HD21 ' A' ' 66' ' ' LEU . 0.4 OUTLIER -98.54 159.02 15.23 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.61 0.243 . . . . 0.0 110.771 179.735 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.423 ' HG ' HD13 ' A' ' 66' ' ' LEU . 0.1 OUTLIER -91.93 126.41 37.0 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.816 -179.979 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -86.48 86.43 7.34 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.772 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.412 HD11 ' CD2' ' A' ' 75' ' ' LEU . 30.5 mm -104.15 128.22 57.75 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.052 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -114.58 118.74 34.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.688 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.604 HD21 ' HB3' ' A' ' 8' ' ' PHE . 0.2 OUTLIER -108.18 131.9 54.18 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.456 179.773 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.1 pp -125.59 151.1 46.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.09 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . 0.524 ' HA ' HD23 ' A' ' 40' ' ' LEU . 1.1 p -65.57 146.92 54.24 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.067 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 . . . . . 0 C--O 1.234 0.287 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 179.88 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 . . . . . 0 N--CA 1.467 0.416 0 CA-C-O 120.812 0.339 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.4 t -111.03 100.19 10.25 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.988 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.6 mtt180 -89.34 108.63 19.74 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.799 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.523 HG21 HD12 ' A' ' 77' ' ' ILE . 7.0 mt -106.46 134.59 47.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.216 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.9 mmtt -103.1 121.29 42.31 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.735 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -109.41 138.45 45.75 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.974 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.406 ' HG3' ' HG2' ' A' ' 14' ' ' ARG . 1.3 tt0 -119.28 126.0 50.43 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.18 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -138.04 121.0 16.59 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.608 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 59.09 31.63 21.47 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.26 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.2 -35.78 3.98 Favored Glycine 0 C--N 1.337 0.638 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.775 -179.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -66.99 146.35 54.47 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.871 0.367 . . . . 0.0 111.219 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.406 ' HG2' ' HG3' ' A' ' 9' ' ' GLU . 22.6 mtm105 -113.51 147.18 38.39 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.361 -179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.94 136.28 40.3 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.087 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.6 mp -116.74 118.26 58.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.906 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.6 mt -127.98 136.49 60.13 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-O 120.863 0.363 . . . . 0.0 111.313 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.6 143.83 26.36 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.249 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.584 ' CE2' HG22 ' A' ' 28' ' ' VAL . 16.3 m-85 -130.79 133.66 46.17 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.08 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.88 132.58 35.22 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.986 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.5 mtt180 -80.74 155.44 73.3 Favored Pre-proline 0 N--CA 1.464 0.226 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.087 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -72.75 124.68 9.44 Favored 'Cis proline' 0 C--N 1.349 0.579 0 C-N-CA 123.67 -1.388 . . . . 0.0 112.379 0.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.1 p -72.7 141.79 15.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.226 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.53 ' O ' HG23 ' A' ' 28' ' ' VAL . 11.0 mmtt -118.59 128.44 54.56 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.9 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -57.41 -36.59 71.52 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.78 179.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.26 -44.77 94.2 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.089 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -69.05 -44.36 72.8 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.124 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.705 ' O ' HG23 ' A' ' 32' ' ' VAL . 38.6 t -66.43 -47.47 83.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.151 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -61.47 -45.64 93.42 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.125 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -62.66 -45.2 93.91 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.723 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.751 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.4 OUTLIER -63.36 -49.34 74.26 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.408 179.921 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.705 HG23 ' O ' ' A' ' 28' ' ' VAL . 56.0 t -60.94 -42.65 93.65 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.377 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 92.1 m -61.98 -39.46 92.26 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.056 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.8 m -72.28 -41.4 66.73 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 111.6 0.222 . . . . 0.0 111.6 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.751 HG23 ' O ' ' A' ' 31' ' ' LYS . 50.7 t -60.0 -52.49 60.57 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-O 120.575 0.226 . . . . 0.0 111.545 -179.402 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -88.42 -23.24 23.37 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -179.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.499 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 104.25 -176.08 23.26 Favored Glycine 0 CA--C 1.523 0.588 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.371 -179.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -137.35 156.79 75.02 Favored Pre-proline 0 N--CA 1.466 0.349 0 CA-C-O 120.624 0.249 . . . . 0.0 111.134 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -85.85 140.17 26.64 Favored 'Cis proline' 0 C--N 1.349 0.574 0 C-N-CA 123.451 -1.479 . . . . 0.0 112.979 0.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.499 HD12 ' O ' ' A' ' 37' ' ' GLY . 21.8 mt -137.73 139.14 39.97 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.947 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -106.65 136.88 45.69 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.163 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 66.7 mt -86.54 108.74 18.7 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.048 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -112.23 119.96 40.13 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.899 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.402 ' HB3' ' CD2' ' A' ' 53' ' ' LEU . 10.3 t80 -106.33 130.06 54.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.562 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.1 ppp? -130.6 122.81 28.15 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.953 0.406 . . . . 0.0 110.937 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -79.12 -41.43 28.6 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.529 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -170.24 -67.18 0.02 OUTLIER 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.553 179.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -111.44 -24.64 10.05 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.634 179.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.457 HD13 ' N ' ' A' ' 50' ' ' SER . 0.2 OUTLIER -105.74 138.77 41.38 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.656 0.265 . . . . 0.0 111.328 -179.563 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.457 ' N ' HD13 ' A' ' 49' ' ' LEU . 17.0 t -110.09 131.06 55.39 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.711 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.3 mt -113.56 134.16 57.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.604 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.0 mt -84.47 118.04 24.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.034 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.562 HD13 ' CB ' ' A' ' 58' ' ' ASP . 3.4 mm? -86.33 100.0 11.99 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.312 179.513 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.6 mttt -135.22 25.22 3.53 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.932 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -173.5 157.18 3.17 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.653 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -61.09 -32.33 72.0 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.654 179.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.75 -45.82 81.77 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.888 179.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.562 ' CB ' HD13 ' A' ' 53' ' ' LEU . 8.1 m-20 -60.47 -42.29 95.95 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.814 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 13.6 tp -66.71 -42.6 86.12 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.804 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.896 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.2 OUTLIER -62.73 -38.88 92.23 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.379 179.977 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -39.93 95.67 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.804 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.99 -36.33 83.18 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.096 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.896 HD12 ' HA ' ' A' ' 60' ' ' ASP . 14.4 mt -65.18 -44.22 95.38 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.139 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.826 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -55.44 -45.78 76.77 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.082 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 10.7 mt -67.19 -40.44 85.15 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.607 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.491 HD21 ' O ' ' A' ' 73' ' ' LYS . 0.5 OUTLIER -64.0 -44.1 93.68 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.002 179.598 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -57.2 -34.58 68.65 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.183 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.2 mtp85 -73.66 -31.36 63.44 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.474 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.8 t -96.36 101.03 12.6 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.367 -179.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.7 t -59.74 -38.44 81.74 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.18 179.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 56.3 p -59.12 -36.12 74.63 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.236 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.34 149.36 30.3 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.065 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.491 ' O ' HD21 ' A' ' 66' ' ' LEU . 22.3 mttp -144.0 -47.23 0.27 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.148 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 95.4 p -101.89 167.65 9.93 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.95 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.1 mt -104.91 130.7 53.02 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.049 -179.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.33 81.26 8.43 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.938 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.523 HD12 HG21 ' A' ' 6' ' ' ILE . 24.3 mt -102.69 116.78 47.02 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.685 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 46.3 mt -101.95 117.34 34.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.614 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.419 HD13 HD13 ' A' ' 40' ' ' LEU . 1.8 pp -101.92 131.85 48.06 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.902 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.2 mp -129.35 155.12 46.14 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.027 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . 0.468 ' HA ' HD23 ' A' ' 40' ' ' LEU . 0.4 OUTLIER -65.75 146.31 54.93 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.913 179.864 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.19 0 CA-C-N 116.266 -0.425 . . . . 0.0 112.093 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 . . . . . 0 N--CA 1.468 0.437 0 CA-C-O 120.9 0.381 . . . . 0.0 111.308 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.2 t -108.56 128.59 64.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.447 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.6 mtt180 -89.88 113.23 24.8 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.796 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.506 ' CG2' HD12 ' A' ' 77' ' ' ILE . 3.0 mt -103.34 133.83 46.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.145 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -94.13 128.54 40.6 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.757 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.508 ' HB3' HD21 ' A' ' 79' ' ' LEU . 96.8 m-85 -116.96 132.23 56.75 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.909 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.404 ' HA ' ' O ' ' A' ' 13' ' ' GLU . 1.8 mt-10 -119.09 123.46 44.5 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.04 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 -129.35 118.0 21.53 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.734 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 57.92 33.68 23.47 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.472 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.67 -29.08 9.57 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.989 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.404 ' O ' ' HA ' ' A' ' 9' ' ' GLU . 17.7 tt0 -64.79 148.3 51.51 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.707 0.289 . . . . 0.0 111.131 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.2 mtp180 -120.35 134.55 55.24 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.136 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 50.8 mtp180 -142.99 149.61 38.54 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.305 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.0 mt -114.46 133.76 59.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.242 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 23.8 mt -137.58 130.76 42.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.209 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.78 141.34 28.55 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.199 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -137.48 132.42 33.28 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.132 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.5 m -84.55 125.41 32.39 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.869 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 54.9 mtm180 -89.44 154.67 48.78 Favored Pre-proline 0 CA--C 1.529 0.155 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.116 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -74.61 121.07 6.98 Favored 'Cis proline' 0 C--N 1.351 0.663 0 C-N-CA 123.725 -1.365 . . . . 0.0 112.506 0.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.8 p -101.77 131.36 49.84 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.8 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp -78.28 144.56 36.03 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.825 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.514 ' CD1' HD13 ' A' ' 59' ' ' LEU . 50.8 t80 -56.77 -39.56 74.28 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.79 179.426 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.417 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -62.9 -36.01 81.95 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.15 179.696 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -67.92 -44.1 77.65 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 116.697 -0.228 . . . . 0.0 110.98 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.469 ' O ' HG23 ' A' ' 32' ' ' VAL . 31.6 t -63.84 -47.33 91.26 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.956 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.417 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 13.0 pt-20 -66.75 -35.08 79.27 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.085 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -56.43 -45.39 80.77 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.628 0.251 . . . . 0.0 110.852 179.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.662 ' O ' HG23 ' A' ' 35' ' ' VAL . 5.4 mmmt -68.25 -49.26 61.82 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.91 179.66 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 28' ' ' VAL . 40.1 t -61.25 -40.67 86.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.477 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.501 HG23 ' HB3' ' A' ' 38' ' ' GLN . 98.1 m -66.45 -41.72 88.67 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.069 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.3 m -72.63 -43.53 63.11 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 111.68 0.252 . . . . 0.0 111.68 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.662 HG23 ' O ' ' A' ' 31' ' ' LYS . 60.7 t -66.28 -44.06 91.33 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -179.304 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.535 ' HB2' HD11 ' A' ' 40' ' ' LEU . 18.0 m-85 -103.46 10.88 37.03 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -179.081 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.02 171.16 10.76 Favored Glycine 0 C--N 1.338 0.673 0 C-N-CA 120.736 -0.745 . . . . 0.0 113.057 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.501 ' HB3' HG23 ' A' ' 33' ' ' THR . 2.2 pt20 -120.29 159.19 48.65 Favored Pre-proline 0 N--CA 1.466 0.337 0 O-C-N 122.821 -0.223 . . . . 0.0 110.785 179.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -89.05 153.69 32.31 Favored 'Cis proline' 0 C--N 1.351 0.662 0 C-N-CA 123.846 -1.314 . . . . 0.0 113.477 0.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.535 HD11 ' HB2' ' A' ' 36' ' ' PHE . 48.3 mt -138.19 133.17 32.92 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.977 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.443 ' OD1' HD11 ' A' ' 52' ' ' LEU . 1.6 t0 -105.77 134.78 48.34 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.808 179.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.2 102.71 14.75 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.146 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.426 ' HA ' HD12 ' A' ' 52' ' ' LEU . 0.8 OUTLIER -101.5 122.12 43.22 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.229 -179.723 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.754 ' HB2' HD11 ' A' ' 53' ' ' LEU . 10.9 t80 -103.78 130.52 51.32 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.725 179.581 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 8.3 mtt -117.22 124.12 48.3 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.623 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -84.92 -61.92 1.66 Allowed 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.225 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -164.12 -64.12 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.694 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -112.83 -13.38 13.19 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.524 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.7 tp -120.44 143.76 48.32 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-O 120.69 0.281 . . . . 0.0 111.319 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.4 m -100.89 124.71 46.98 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.751 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.4 mt -118.59 133.51 65.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.001 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.589 HD23 ' HE2' ' A' ' 54' ' ' LYS . 14.1 tp -103.38 134.5 46.65 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.84 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.754 HD11 ' HB2' ' A' ' 44' ' ' TYR . 3.6 mp -84.89 84.31 7.75 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.751 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.589 ' HE2' HD23 ' A' ' 52' ' ' LEU . 67.5 mttm -90.28 -35.11 15.47 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.207 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -120.86 159.65 25.06 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.914 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.5 tm0? -60.16 -33.75 72.61 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.962 179.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.57 -40.61 79.32 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.093 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.67 -42.72 97.63 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.778 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.528 HD12 ' CD2' ' A' ' 53' ' ' LEU . 3.8 tp -68.46 -40.06 81.18 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.953 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.424 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.8 OUTLIER -61.33 -43.38 98.96 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.075 179.913 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.68 -35.74 79.39 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.85 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.64 -40.21 96.31 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.542 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.424 HD12 ' HA ' ' A' ' 60' ' ' ASP . 13.8 mt -64.16 -41.17 91.59 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 116.732 -0.213 . . . . 0.0 111.008 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -54.84 -40.13 69.29 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.028 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 44.4 mt -67.85 -42.01 85.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.811 179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.4 tp -65.54 -45.88 81.73 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.729 179.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.56 -39.63 77.12 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.105 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.1 mmt-85 -61.93 -34.37 75.96 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.213 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 42.5 t -84.8 105.26 15.45 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.907 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 85.6 p -67.59 -32.16 72.72 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.017 179.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.2 t -67.32 -43.14 82.35 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.953 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.42 120.98 25.68 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.103 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.46 -40.09 4.74 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.185 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 53.6 p -91.6 167.51 12.16 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.66 -0.246 . . . . 0.0 111.111 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.453 HD22 HD11 ' A' ' 77' ' ' ILE . 0.2 OUTLIER -107.57 131.12 54.69 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.23 -179.966 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -91.41 86.8 6.2 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.69 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.506 HD12 ' CG2' ' A' ' 6' ' ' ILE . 29.4 mt -117.95 129.3 74.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.004 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.99 117.58 32.44 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.836 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.508 HD21 ' HB3' ' A' ' 8' ' ' PHE . 0.5 OUTLIER -99.0 131.04 45.34 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.97 179.962 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 pp -122.93 130.57 53.0 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.705 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . 0.421 ' HA ' HD23 ' A' ' 40' ' ' LEU . 39.4 t -75.99 135.7 40.0 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.767 179.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 34.8 tp60 . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.989 179.659 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.233 0.208 0 CA-C-O 121.006 0.432 . . . . 0.0 110.498 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 38.2 t -77.68 128.89 37.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.584 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 23.2 mtm180 -93.14 115.59 28.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.805 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.564 HD12 ' CD1' ' A' ' 19' ' ' PHE . 24.7 mt -108.31 128.68 63.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.856 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 39.4 mttt -106.23 126.99 52.9 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.009 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.416 ' HD1' HD23 ' A' ' 79' ' ' LEU . 89.2 m-85 -114.43 143.28 45.17 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.083 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -128.02 127.99 44.18 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.997 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.0 t-160 -143.1 118.88 10.51 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.602 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 58.4 37.29 25.79 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.345 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 91.57 -47.14 2.78 Favored Glycine 0 C--N 1.334 0.437 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.719 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.49 141.14 52.0 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.733 0.301 . . . . 0.0 110.92 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -125.06 149.75 47.49 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.323 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.51 139.46 50.5 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.948 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.4 mp -99.73 133.23 43.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.954 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 9.1 tp -129.46 137.58 56.51 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.395 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.87 131.38 35.83 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.994 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.745 ' CE2' HG22 ' A' ' 28' ' ' VAL . 6.6 m-85 -132.34 125.81 31.77 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.228 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.4 m -98.86 142.84 29.87 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.882 179.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 68.4 mtt180 -74.02 151.15 88.32 Favored Pre-proline 0 N--CA 1.464 0.245 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.948 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.75 125.87 12.47 Favored 'Cis proline' 0 C--N 1.352 0.715 0 C-N-CA 123.474 -1.469 . . . . 0.0 112.658 0.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.468 ' O ' HG13 ' A' ' 23' ' ' VAL . 11.9 p -89.61 114.94 28.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.077 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.592 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -99.66 137.16 38.53 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.106 -179.55 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.438 ' HD1' HD22 ' A' ' 59' ' ' LEU . 72.7 t80 -56.47 -40.31 74.64 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.141 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -63.57 -44.75 93.17 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.101 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -66.36 -44.28 83.62 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.374 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.745 HG22 ' CE2' ' A' ' 19' ' ' PHE . 43.1 t -65.35 -47.66 86.19 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.721 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -59.89 -42.66 94.31 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.095 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.82 -42.4 79.53 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.056 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.791 ' O ' HG23 ' A' ' 35' ' ' VAL . 13.9 mtpt -69.49 -49.63 52.92 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.028 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.547 HG23 ' O ' ' A' ' 28' ' ' VAL . 34.9 t -61.3 -40.55 86.49 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.441 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.498 HG23 ' HB3' ' A' ' 38' ' ' GLN . 88.5 m -59.3 -41.73 89.69 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.844 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 48.7 m -72.13 -31.76 66.3 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 111.464 0.172 . . . . 0.0 111.464 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 31' ' ' LYS . 48.1 t -63.95 -55.88 19.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 111.632 0.234 . . . . 0.0 111.632 -179.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.63 ' HB2' HD11 ' A' ' 40' ' ' LEU . 77.7 m-85 -97.56 -10.66 24.8 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 -178.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.97 -172.41 24.55 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.475 -179.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.498 ' HB3' HG23 ' A' ' 33' ' ' THR . 1.4 pt20 -143.65 156.81 59.6 Favored Pre-proline 0 N--CA 1.465 0.277 0 O-C-N 122.83 -0.218 . . . . 0.0 111.338 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -81.44 153.31 80.08 Favored 'Cis proline' 0 C--N 1.35 0.636 0 C-N-CA 123.803 -1.332 . . . . 0.0 112.884 0.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.63 HD11 ' HB2' ' A' ' 36' ' ' PHE . 48.0 mt -136.01 149.08 48.69 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.029 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -116.0 120.23 38.47 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.793 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.434 HD12 ' OH ' ' A' ' 25' ' ' TYR . 73.2 mt -81.95 97.29 8.01 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.727 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -97.9 113.71 25.61 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.286 -179.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.752 ' HB2' HD11 ' A' ' 53' ' ' LEU . 14.1 t80 -98.85 123.56 43.19 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.717 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.4 mtt -126.23 131.86 51.85 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.673 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -76.91 -43.92 33.73 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.631 179.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -173.93 -49.85 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.605 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -119.34 -36.58 3.33 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.375 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.8 mp -95.26 134.14 38.36 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.827 0.346 . . . . 0.0 111.24 -179.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 98.1 p -105.04 121.2 43.29 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.844 179.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.4 mt -114.75 132.49 63.77 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.86 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.546 HD23 ' N ' ' A' ' 53' ' ' LEU . 4.9 tt -88.26 132.91 34.2 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.658 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.752 HD11 ' HB2' ' A' ' 44' ' ' TYR . 2.4 mt -103.01 94.67 5.67 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.69 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.532 ' HD2' HD22 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -110.07 27.66 9.38 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.486 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -173.45 164.92 4.65 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.919 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.42 -37.15 86.53 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.548 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -58.51 -40.9 84.16 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.653 -0.249 . . . . 0.0 110.909 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.551 ' HB3' HD23 ' A' ' 53' ' ' LEU . 20.3 m-20 -65.79 -43.79 87.67 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.781 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.579 HD12 HD13 ' A' ' 53' ' ' LEU . 7.2 tp -67.21 -41.76 85.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.802 179.401 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.593 ' HA ' HD12 ' A' ' 63' ' ' ILE . 5.4 t70 -63.85 -43.1 97.16 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.932 179.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.4 tttm -63.87 -32.13 73.54 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.411 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.77 -40.38 97.09 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.389 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.593 HD12 ' HA ' ' A' ' 60' ' ' ASP . 5.0 mt -64.42 -40.92 90.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.935 179.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -55.32 -34.95 64.62 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.001 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 41.7 mt -65.96 -40.92 88.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.085 179.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.593 HD22 HD21 ' A' ' 75' ' ' LEU . 12.4 tp -65.33 -45.02 85.93 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.768 179.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -56.97 -39.42 74.57 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.608 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -65.05 -32.76 74.64 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.203 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.5 t -70.04 146.5 50.95 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.809 0.338 . . . . 0.0 111.278 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 2.3 m -76.3 -34.82 59.06 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.426 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.3 p -77.79 -52.23 9.24 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.285 -179.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 13.9 ptt? 40.56 86.46 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.547 0 O-C-N 123.484 0.49 . . . . 0.0 112.223 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.09 82.78 2.07 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.961 0.41 . . . . 0.0 111.173 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.562 ' C ' HD22 ' A' ' 75' ' ' LEU . 0.4 OUTLIER 63.28 -179.37 0.15 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.44 179.856 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.593 HD21 HD22 ' A' ' 66' ' ' LEU . 3.5 mm? -122.31 122.47 39.15 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.077 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.3 mtt180 -83.4 93.81 7.84 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.004 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.3 mt -109.06 128.09 65.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.869 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.5 mp -103.64 126.45 50.79 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.192 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.416 HD23 ' HD1' ' A' ' 8' ' ' PHE . 3.8 pp -111.13 136.22 50.5 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.786 0.327 . . . . 0.0 111.169 179.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.1 mp -128.95 155.38 45.42 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.976 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . 0.63 ' HA ' HD23 ' A' ' 40' ' ' LEU . 0.9 OUTLIER -85.9 141.44 29.57 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.162 179.916 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.466 0.328 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.995 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.402 0 CA-C-O 120.951 0.405 . . . . 0.0 111.064 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.8 t -84.27 124.42 39.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.033 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.447 ' HG3' ' HB2' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -92.36 117.44 29.91 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.858 179.89 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.401 ' CG2' HD12 ' A' ' 77' ' ' ILE . 2.3 mt -103.64 130.42 54.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.12 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 tmtt? -110.55 114.42 27.82 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.711 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 12.2 p90 -113.34 146.96 38.58 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.079 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -124.48 143.95 50.37 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.106 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -140.39 111.84 7.3 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.678 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 54.58 34.49 21.4 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.645 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 104.75 -42.48 1.89 Allowed Glycine 0 C--N 1.334 0.459 0 C-N-CA 120.921 -0.657 . . . . 0.0 112.741 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.55 135.46 56.02 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.689 0.28 . . . . 0.0 111.076 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -115.05 154.08 29.52 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.596 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -151.79 136.37 16.98 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.157 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.42 ' O ' HD13 ' A' ' 17' ' ' ILE . 25.7 mt -114.38 126.56 71.94 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.135 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.42 HD13 ' O ' ' A' ' 16' ' ' ILE . 26.2 mm -130.63 131.13 64.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.12 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.447 ' HB2' ' HG3' ' A' ' 5' ' ' ARG . . . -95.66 134.05 39.01 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.13 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.44 ' CE2' HG13 ' A' ' 28' ' ' VAL . 9.5 m-85 -126.94 124.19 38.92 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.201 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -80.87 150.26 29.15 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.052 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.499 ' HD2' HG12 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -91.42 152.01 43.26 Favored Pre-proline 0 CA--C 1.532 0.274 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.256 179.995 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -76.04 131.3 23.82 Favored 'Cis proline' 0 C--N 1.35 0.629 0 C-N-CA 123.233 -1.57 . . . . 0.0 112.318 -0.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.499 HG12 ' HD2' ' A' ' 21' ' ' ARG . 14.9 p -119.96 123.55 71.04 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.043 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.443 ' O ' HG23 ' A' ' 28' ' ' VAL . 39.7 mttp -91.79 151.09 20.76 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.08 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -62.65 -35.99 81.42 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.895 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -63.37 -44.66 94.14 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.987 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.67 -44.4 93.88 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.392 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 24' ' ' LYS . 39.4 t -67.73 -47.62 79.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 120.777 0.322 . . . . 0.0 110.685 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -63.42 -44.5 94.42 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.36 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -56.33 -39.04 72.17 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.471 -179.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.791 ' O ' HG23 ' A' ' 35' ' ' VAL . 6.7 tttt -64.13 -47.58 79.39 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-O 120.64 0.257 . . . . 0.0 110.556 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 28' ' ' VAL . 20.7 t -63.52 -40.25 88.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.691 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.641 HG22 ' HG3' ' A' ' 38' ' ' GLN . 0.1 OUTLIER -59.28 -40.69 86.91 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 116.856 -0.156 . . . . 0.0 111.112 -179.932 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.9 m -72.47 -33.25 66.87 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.436 0.16 . . . . 0.0 111.088 179.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 31' ' ' LYS . 44.7 t -68.03 -53.1 32.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.485 ' HB2' HD11 ' A' ' 40' ' ' LEU . 30.6 m-85 -99.85 9.12 43.52 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -179.124 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.86 176.46 26.41 Favored Glycine 0 C--N 1.335 0.524 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.877 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.641 ' HG3' HG22 ' A' ' 33' ' ' THR . 1.3 mt-30 -124.35 158.54 60.95 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-O 120.467 0.175 . . . . 0.0 110.944 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -90.07 153.51 27.53 Favored 'Cis proline' 0 C--N 1.348 0.526 0 C-N-CA 123.901 -1.291 . . . . 0.0 113.175 0.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.578 HD23 ' HA ' ' A' ' 81' ' ' SER . 78.1 mt -138.54 148.35 44.14 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.942 179.573 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -115.16 123.58 49.28 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.663 179.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.548 HD23 ' HB3' ' A' ' 79' ' ' LEU . 81.1 mt -88.32 102.01 14.44 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.182 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -96.59 122.01 39.05 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.024 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.647 ' CZ ' ' HB1' ' A' ' 62' ' ' ALA . 15.2 t80 -104.3 119.04 38.07 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.47 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 27.6 mmm -94.32 130.97 40.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.768 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -82.5 -50.39 8.89 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.874 0.369 . . . . 0.0 110.348 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -172.41 -63.51 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.009 179.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -107.14 -28.95 9.65 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.485 179.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.6 mt -109.12 162.98 13.75 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.919 0.39 . . . . 0.0 111.525 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.24 125.39 53.04 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.186 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.6 mm -116.61 132.7 65.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.944 179.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.495 HD12 ' O ' ' A' ' 42' ' ' LEU . 37.6 tp -94.75 126.55 40.14 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.841 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.444 HD21 ' CB ' ' A' ' 44' ' ' TYR . 15.6 mt -79.93 131.67 35.88 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.727 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.4 mmtt -108.04 -38.39 5.8 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.393 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 39.3 p30 -152.78 -172.3 4.2 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.041 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -55.98 -36.35 67.77 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.974 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.73 -44.99 70.35 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.859 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.64 -35.38 80.63 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.871 179.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.5 tp -72.91 -38.37 66.92 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.145 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -62.28 -43.38 98.96 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.263 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.3 ptpt -69.23 -30.77 68.99 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.808 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.647 ' HB1' ' CZ ' ' A' ' 44' ' ' TYR . . . -63.24 -39.4 94.49 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.294 179.751 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 21.6 mt -62.95 -40.89 90.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.838 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -55.82 -38.42 69.98 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.082 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 31.9 mm -68.77 -38.02 78.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.96 179.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.3 tp -62.28 -36.95 83.67 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.027 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.425 ' HA ' ' HG3' ' A' ' 72' ' ' MET . 14.6 t70 -57.9 -36.89 73.06 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.956 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 9.2 mtt-85 -65.74 -32.38 73.9 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.833 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 26.2 t -68.66 165.06 20.16 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.147 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.95 -37.73 38.85 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.861 -179.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.82 -69.75 0.27 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.649 -0.251 . . . . 0.0 111.483 -179.295 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.425 ' HG3' ' HA ' ' A' ' 67' ' ' ASP . 2.0 ttm 53.83 30.49 11.47 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 120.759 0.314 . . . . 0.0 111.422 -179.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.7 mmpt? -117.8 -31.25 5.19 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.687 -0.233 . . . . 0.0 111.28 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.2 p -126.53 165.57 18.88 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.928 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.505 HD12 ' HE2' ' A' ' 44' ' ' TYR . 2.7 mm? -113.5 122.25 46.7 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.626 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.2 mtt-85 -82.95 93.62 7.57 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 120.837 0.351 . . . . 0.0 110.762 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.401 HD12 ' CG2' ' A' ' 6' ' ' ILE . 17.2 mt -126.11 131.43 71.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.133 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.8 tp -115.27 117.04 29.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.522 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.548 ' HB3' HD23 ' A' ' 42' ' ' LEU . 3.8 pp -110.57 135.41 51.25 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.768 0.318 . . . . 0.0 110.952 179.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.1 mt -135.74 154.14 51.34 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.677 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . 0.578 ' HA ' HD23 ' A' ' 40' ' ' LEU . 6.2 t -89.67 145.07 25.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.984 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.277 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 . . . . . 0 N--CA 1.466 0.355 0 CA-C-O 120.809 0.338 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.412 HG23 ' HG3' ' A' ' 21' ' ' ARG . 19.2 t -108.56 123.7 64.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.334 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.91 106.62 18.52 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.594 179.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 23.0 mt -107.09 124.69 63.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.123 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.413 ' HG2' ' HA ' ' A' ' 76' ' ' ARG . 0.0 OUTLIER -101.6 116.98 33.96 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.764 179.544 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.61 ' CD1' HD23 ' A' ' 79' ' ' LEU . 20.5 m-85 -104.27 139.92 38.59 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.943 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.528 ' HB3' HD12 ' A' ' 78' ' ' LEU . 1.0 OUTLIER -123.37 132.25 53.91 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.95 -179.991 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -142.12 117.05 9.92 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.786 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 57.97 35.62 25.44 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.335 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.06 -35.46 4.17 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.839 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -64.8 135.99 56.4 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.737 0.268 . . . . 0.0 110.932 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -117.35 140.18 49.9 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.22 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 25.1 mtt-85 -148.25 136.4 21.16 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.234 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.5 mt -105.14 125.04 60.24 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.233 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 26.0 mm -115.78 133.08 63.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.104 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.4 132.16 37.91 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.104 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -128.01 146.03 50.79 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.196 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.52 141.73 28.41 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.998 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.412 ' HG3' HG23 ' A' ' 4' ' ' VAL . 12.8 mtm180 -98.2 138.6 20.9 Favored Pre-proline 0 C--O 1.233 0.192 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.017 179.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -75.14 146.93 87.8 Favored 'Cis proline' 0 C--N 1.35 0.615 0 C-N-CA 123.773 -1.345 . . . . 0.0 112.446 0.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.415 ' O ' HG13 ' A' ' 23' ' ' VAL . 12.4 p -117.56 121.03 66.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 120.918 0.39 . . . . 0.0 111.008 179.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.423 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -75.58 130.62 39.1 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.875 -179.97 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.41 ' OH ' HD13 ' A' ' 42' ' ' LEU . 74.9 t80 -55.31 -35.76 65.48 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.983 179.501 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -60.72 -42.37 97.14 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.879 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -67.91 -43.12 79.96 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.919 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.663 ' O ' HG23 ' A' ' 32' ' ' VAL . 21.2 t -61.96 -47.02 95.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.95 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.443 ' HG3' ' N ' ' A' ' 30' ' ' HIS . 10.5 pt-20 -65.72 -42.27 91.26 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.927 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.443 ' N ' ' HG3' ' A' ' 29' ' ' GLU . 0.8 OUTLIER -56.47 -42.48 78.3 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.233 -179.971 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.823 ' O ' HG23 ' A' ' 35' ' ' VAL . 11.9 tttt -70.25 -49.16 52.72 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.051 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.663 HG23 ' O ' ' A' ' 28' ' ' VAL . 24.4 t -63.19 -40.75 90.22 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.388 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.724 HG23 ' HB3' ' A' ' 38' ' ' GLN . 60.3 m -58.56 -42.56 88.23 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.057 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.1 m -72.31 -35.29 68.61 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 120.484 0.183 . . . . 0.0 111.452 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.823 HG23 ' O ' ' A' ' 31' ' ' LYS . 49.1 t -67.69 -50.71 58.13 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -179.5 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.409 ' HB2' ' CD1' ' A' ' 40' ' ' LEU . 18.4 m-85 -103.97 10.92 36.01 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -179.05 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.63 172.4 9.39 Favored Glycine 0 CA--C 1.523 0.545 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.906 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.724 ' HB3' HG23 ' A' ' 33' ' ' THR . 5.1 pt20 -128.63 158.82 70.81 Favored Pre-proline 0 N--CA 1.463 0.213 0 CA-C-O 120.457 0.17 . . . . 0.0 110.709 179.571 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -87.57 153.88 41.46 Favored 'Cis proline' 0 C--N 1.35 0.638 0 C-N-CA 123.834 -1.319 . . . . 0.0 113.441 0.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.538 HD13 HD13 ' A' ' 79' ' ' LEU . 47.6 mt -138.93 155.69 47.84 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.703 179.637 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -114.54 134.12 55.27 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.842 0.353 . . . . 0.0 110.83 179.223 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.41 HD13 ' OH ' ' A' ' 25' ' ' TYR . 5.4 mp -91.39 103.75 16.35 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.943 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.413 ' CD2' ' HB2' ' A' ' 50' ' ' SER . 0.1 OUTLIER -111.15 122.18 47.22 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.337 -179.552 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.772 ' HB3' HD11 ' A' ' 53' ' ' LEU . 13.4 t80 -124.32 130.52 52.66 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.699 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.43 133.14 49.97 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.799 179.473 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -63.74 -56.23 17.21 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.735 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -157.43 -53.94 0.07 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.583 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -127.04 7.79 6.64 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.522 179.459 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.2 mt -131.39 138.65 49.21 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.474 0.178 . . . . 0.0 110.895 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.413 ' HB2' ' CD2' ' A' ' 43' ' ' HIS . 29.9 p -110.33 131.62 54.89 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.964 179.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 24.4 mt -130.28 134.62 62.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.974 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.8 133.55 33.98 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.925 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.772 HD11 ' HB3' ' A' ' 44' ' ' TYR . 0.2 OUTLIER -126.26 87.98 2.76 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.773 179.916 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -109.12 26.72 10.3 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.988 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -154.7 154.16 32.44 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.774 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.0 tp60 -60.55 -34.03 73.55 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.853 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -59.7 -50.63 73.12 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.02 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.05 -42.91 99.68 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.841 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 15.1 tp -60.93 -40.75 94.4 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.01 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.578 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.3 OUTLIER -61.63 -41.53 97.61 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.908 179.744 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 15.6 mtpt -63.5 -36.84 85.08 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.77 -36.45 83.13 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.106 179.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.578 HD12 ' HA ' ' A' ' 60' ' ' ASP . 39.3 mt -60.16 -44.01 94.33 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.962 179.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -54.4 -41.31 69.13 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.967 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 46.2 mt -65.18 -46.21 91.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.019 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.1 mt -63.06 -39.35 94.47 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.914 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -57.99 -37.33 74.05 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.11 179.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.3 mmt180 -62.25 -35.13 78.01 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.206 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 33.1 t -88.76 112.19 22.89 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.123 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.2 m -72.6 -33.72 66.91 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.898 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.7 p -74.82 -37.08 62.4 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.491 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -90.37 111.92 23.33 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.085 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.6 pttt -126.41 32.17 5.24 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.932 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 61.4 p -146.64 153.64 40.54 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.121 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.5 mp -104.07 116.76 32.81 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.12 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.413 ' HA ' ' HG2' ' A' ' 7' ' ' LYS . 6.4 ttm180 -90.17 91.86 8.71 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.698 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.8 mt -110.31 122.75 65.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.004 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.528 HD12 ' HB3' ' A' ' 9' ' ' GLU . 0.8 OUTLIER -105.83 117.56 34.34 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.767 179.773 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.61 HD23 ' CD1' ' A' ' 8' ' ' PHE . 3.6 pp -109.38 133.22 53.33 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.788 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.1 pp -118.07 154.62 31.76 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.841 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . 0.444 ' HA ' HD23 ' A' ' 40' ' ' LEU . 25.9 m -97.06 135.57 38.86 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.76 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.285 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.584 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.414 ' OD1' ' HB1' ' A' ' 18' ' ' ALA . 3.7 t70 . . . . . 0 N--CA 1.466 0.366 0 CA-C-O 121.043 0.449 . . . . 0.0 111.207 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.4 t -128.32 137.77 56.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.152 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.55 116.08 28.49 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.432 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.698 HD13 ' HD2' ' A' ' 19' ' ' PHE . 4.0 mp -117.67 131.15 71.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.974 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 26.6 tttt -106.63 129.18 54.59 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.929 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -114.73 134.41 55.12 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.881 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.407 ' HB3' HD13 ' A' ' 78' ' ' LEU . 3.4 tt0 -119.21 123.85 45.33 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.962 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.4 t-160 -134.81 115.9 14.2 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.624 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 57.93 32.53 22.07 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.301 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 96.06 -34.77 4.72 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.995 -0.622 . . . . 0.0 112.699 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -65.02 136.41 56.75 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.703 0.287 . . . . 0.0 110.932 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 40.9 mtm-85 -108.61 138.78 44.36 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.158 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -132.81 127.83 35.39 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.798 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.8 mp -110.39 123.95 66.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.923 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 33.6 mt -137.44 131.81 44.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 121.029 0.442 . . . . 0.0 111.034 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.414 ' HB1' ' OD1' ' A' ' 3' ' ' ASP . . . -92.03 134.04 35.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.696 -0.683 . . . . 0.0 111.122 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.698 ' HD2' HD13 ' A' ' 6' ' ' ILE . 11.6 m-85 -116.21 119.26 35.2 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.767 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 93.2 p -74.9 131.18 40.51 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.912 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.3 mtm180 -73.95 151.78 88.6 Favored Pre-proline 0 N--CA 1.463 0.223 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.288 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.14 166.18 82.93 Favored 'Cis proline' 0 C--N 1.351 0.668 0 C-N-CA 123.562 -1.433 . . . . 0.0 112.845 0.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.5 p -152.63 153.17 9.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.239 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.551 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -134.31 164.17 28.01 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.491 -179.698 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.462 ' CD2' HD22 ' A' ' 59' ' ' LEU . 6.7 t80 -56.92 -44.65 82.66 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.264 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -58.09 -45.15 87.65 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.396 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.41 ' HB2' ' HG2' ' A' ' 24' ' ' LYS . 2.8 t70 -67.03 -44.42 80.28 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.572 -179.552 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.551 HG23 ' O ' ' A' ' 24' ' ' LYS . 40.0 t -67.9 -46.99 81.01 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.065 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -63.45 -41.49 98.65 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.388 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.6 m80 -56.68 -40.89 76.37 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.641 0.258 . . . . 0.0 111.059 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.797 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.4 OUTLIER -69.78 -49.07 56.44 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.257 -179.962 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 46.4 t -65.39 -42.57 93.83 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 CA-C-N 116.693 -0.231 . . . . 0.0 111.516 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.41 HG23 ' HB3' ' A' ' 38' ' ' GLN . 75.0 m -59.06 -39.67 82.79 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.725 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 29.7 m -72.15 -32.47 66.92 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 121.247 -0.181 . . . . 0.0 111.331 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.797 HG23 ' O ' ' A' ' 31' ' ' LYS . 60.4 t -66.87 -58.28 7.01 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 N-CA-C 111.435 0.161 . . . . 0.0 111.435 -179.652 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.493 ' HB2' HD11 ' A' ' 40' ' ' LEU . 33.0 m-85 -95.85 6.78 48.07 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -179.157 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.506 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 80.09 -176.29 54.72 Favored Glycine 0 C--N 1.336 0.546 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.693 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.41 ' HB3' HG23 ' A' ' 33' ' ' THR . 0.4 OUTLIER -131.28 155.87 80.91 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 120.561 0.22 . . . . 0.0 111.068 -179.9 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -90.61 153.72 25.34 Favored 'Cis proline' 0 C--N 1.349 0.601 0 C-N-CA 123.744 -1.357 . . . . 0.0 113.273 0.28 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.506 HD12 ' O ' ' A' ' 37' ' ' GLY . 21.5 mt -137.41 141.79 41.67 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.933 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -114.33 127.63 55.95 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.936 179.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 21.0 mt -92.66 112.84 24.94 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.829 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.486 ' CD2' HD12 ' A' ' 52' ' ' LEU . 10.0 t-160 -110.54 120.65 43.11 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.156 -179.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.873 ' HB2' HD21 ' A' ' 53' ' ' LEU . 1.2 t80 -88.76 130.33 35.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.842 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.6 mpp? -126.93 113.96 17.21 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.547 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -72.77 -53.98 10.13 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.733 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -176.68 -56.62 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.343 179.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -107.21 -26.79 10.91 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.536 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.487 HD23 ' N ' ' A' ' 50' ' ' SER . 0.9 OUTLIER -114.04 155.61 25.62 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.882 0.372 . . . . 0.0 111.495 -179.576 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.487 ' N ' HD23 ' A' ' 49' ' ' LEU . 0.7 OUTLIER -118.12 124.94 49.25 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.839 179.624 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 9.6 mt -113.87 133.12 60.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.046 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.486 HD12 ' CD2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -96.84 135.87 38.2 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.806 179.825 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.873 HD21 ' HB2' ' A' ' 44' ' ' TYR . 1.0 OUTLIER -95.33 76.68 3.4 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.617 179.915 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 3.0 pttp -77.37 -35.34 54.59 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.489 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -123.14 165.06 17.48 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.075 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.8 tm0? -59.94 -35.86 75.82 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.807 179.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -53.81 -49.88 67.37 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.91 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -59.17 -46.0 89.55 Favored 'General case' 0 N--CA 1.461 0.125 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.148 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.462 HD22 ' CD2' ' A' ' 25' ' ' TYR . 6.3 tp -66.15 -41.86 89.83 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.885 179.567 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.833 ' HA ' HD12 ' A' ' 63' ' ' ILE . 11.1 t0 -66.27 -42.34 88.62 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.395 -179.616 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -62.75 -36.52 83.31 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.45 179.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.816 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -63.81 -39.14 93.52 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.205 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.833 HD12 ' HA ' ' A' ' 60' ' ' ASP . 8.2 mt -64.53 -42.78 96.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.798 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.11 -37.69 67.18 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.945 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.816 HD12 ' HA ' ' A' ' 62' ' ' ALA . 9.5 mt -65.86 -41.69 90.6 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.879 179.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.497 HD13 HD12 ' A' ' 75' ' ' LEU . 5.9 tt -61.42 -44.21 97.53 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.865 179.541 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.79 -34.41 78.28 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.076 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -67.32 -32.63 73.72 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.406 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.7 t -103.92 109.05 20.66 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.294 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 47.5 t -77.7 -9.17 58.84 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.3 p -89.65 42.53 1.1 Allowed 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 120.758 0.313 . . . . 0.0 111.66 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.81 -173.67 3.63 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.691 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.7 mttm -130.87 -69.05 0.66 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.652 0.263 . . . . 0.0 111.012 179.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -130.52 -173.01 2.95 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.058 -179.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.497 HD12 HD13 ' A' ' 66' ' ' LEU . 1.9 mp -91.9 121.54 33.59 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.452 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.9 tpt180 -76.81 80.34 3.41 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.002 0.429 . . . . 0.0 110.74 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.549 HD12 ' CG2' ' A' ' 6' ' ' ILE . 26.5 mt -103.93 123.24 57.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.754 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.407 HD13 ' HB3' ' A' ' 9' ' ' GLU . 4.0 mm? -103.29 117.29 34.17 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.819 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.1 pp -105.7 127.77 53.27 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.568 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.3 mp -119.82 127.62 52.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.127 -179.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -98.2 131.17 44.78 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.986 179.616 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.354 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.49 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 . . . . . 0 N--CA 1.466 0.341 0 CA-C-O 120.901 0.381 . . . . 0.0 110.87 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 23.2 t -78.48 130.08 36.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.348 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -87.76 123.58 32.71 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.928 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 3.1 mt -118.06 124.53 73.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.643 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.7 mttp -95.07 121.24 36.5 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.796 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -113.15 131.72 55.74 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.689 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.634 ' HB2' HD12 ' A' ' 78' ' ' LEU . 0.6 OUTLIER -119.22 127.91 53.71 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.182 -179.826 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 12.9 t-160 -130.98 117.19 18.84 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.522 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 56.33 32.27 20.16 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.548 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 96.26 -28.08 14.43 Favored Glycine 0 C--N 1.335 0.508 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.012 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.5 148.19 52.15 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.829 0.347 . . . . 0.0 111.273 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.7 ptp85 -109.07 142.59 39.56 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.113 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -141.87 139.95 32.76 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.227 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.1 mp -115.38 131.72 66.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.233 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.739 HD13 ' N ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -145.34 131.38 14.15 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.237 -179.944 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.739 ' N ' HD13 ' A' ' 17' ' ' ILE . . . -103.88 127.68 51.38 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.059 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.649 ' CD2' HD12 ' A' ' 17' ' ' ILE . 5.1 m-85 -113.28 120.7 42.09 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.087 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.3 m -82.55 128.53 34.39 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.931 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.0 mtm180 -78.33 156.8 78.53 Favored Pre-proline 0 N--CA 1.464 0.233 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.912 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.68 126.37 12.89 Favored 'Cis proline' 0 C--N 1.351 0.667 0 C-N-CA 123.566 -1.431 . . . . 0.0 112.667 -0.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.1 p -103.25 147.05 10.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.454 -179.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.412 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -110.66 146.11 36.77 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.109 -179.909 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -59.68 -39.6 85.04 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.629 179.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -43.83 98.14 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.837 179.682 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -64.96 -44.34 89.7 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.425 -179.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.673 ' O ' HG23 ' A' ' 32' ' ' VAL . 43.1 t -68.18 -47.3 78.89 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.125 0 CA-C-O 120.605 0.24 . . . . 0.0 111.156 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.435 ' HG3' HD11 ' A' ' 42' ' ' LEU . 1.4 tt0 -64.28 -45.45 87.98 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.136 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -58.95 -44.36 91.43 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.752 0.31 . . . . 0.0 110.596 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.721 ' O ' HG23 ' A' ' 35' ' ' VAL . 1.2 tttt -64.05 -49.47 72.23 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.228 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.673 HG23 ' O ' ' A' ' 28' ' ' VAL . 43.6 t -64.09 -41.05 91.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-N 116.764 -0.198 . . . . 0.0 111.323 -179.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 95.9 m -61.34 -39.5 90.79 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.993 179.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.3 m -72.42 -40.97 66.73 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 121.137 -0.225 . . . . 0.0 111.344 179.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.721 HG23 ' O ' ' A' ' 31' ' ' LYS . 47.3 t -64.84 -55.1 22.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.173 0 CA-C-O 120.67 0.271 . . . . 0.0 111.353 -179.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -85.95 -7.45 58.66 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -179.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.411 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 86.03 177.15 50.01 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.571 -179.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.94 154.43 79.22 Favored Pre-proline 0 N--CA 1.465 0.301 0 CA-C-O 120.571 0.224 . . . . 0.0 111.044 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -86.91 153.52 45.12 Favored 'Cis proline' 0 C--N 1.349 0.59 0 C-N-CA 123.655 -1.394 . . . . 0.0 113.449 0.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.599 HD23 ' HA ' ' A' ' 81' ' ' SER . 32.6 mt -138.38 157.1 46.89 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.923 179.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -114.43 118.44 33.83 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.002 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.435 HD11 ' HG3' ' A' ' 29' ' ' GLU . 37.5 mt -79.84 100.1 7.84 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.892 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.4 m170 -103.73 112.26 25.13 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.874 0.369 . . . . 0.0 111.247 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -94.96 115.89 28.02 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.23 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.3 ttm -101.84 124.95 48.34 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.986 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -79.56 -41.1 27.95 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.712 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -171.81 -64.17 0.02 OUTLIER 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.334 179.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.81 -29.49 7.95 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.576 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -107.2 155.3 20.05 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.852 0.358 . . . . 0.0 111.291 -179.42 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.6 t -114.81 132.95 56.31 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.983 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 28.9 mt -125.39 134.34 67.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.694 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.5 tt -83.14 132.71 35.07 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.652 0.263 . . . . 0.0 111.093 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.1 mt -87.27 110.67 20.36 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.64 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.07 -64.06 1.18 Allowed 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.45 -179.545 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -136.13 -169.04 2.34 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.82 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -54.12 -30.77 50.1 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -54.14 -42.31 69.38 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.62 0.247 . . . . 0.0 111.119 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.42 -48.46 69.96 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.806 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.3 tt -64.23 -39.63 94.37 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.201 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.643 ' HA ' HD12 ' A' ' 63' ' ' ILE . 10.4 m-20 -61.81 -43.28 99.16 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.746 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.19 -36.33 83.7 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.643 179.311 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.68 -38.95 92.38 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.327 179.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.643 HD12 ' HA ' ' A' ' 60' ' ' ASP . 13.6 mt -64.35 -44.4 97.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.8 0.333 . . . . 0.0 110.642 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -56.48 -42.82 78.9 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.053 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 27.2 mt -69.19 -38.33 77.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.805 179.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 9.6 tp -60.5 -46.0 91.72 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.865 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -60.61 -36.15 77.87 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.718 179.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.6 ttm-85 -63.15 -33.0 74.52 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.28 179.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 31.1 t -72.3 150.9 43.14 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 120.664 0.269 . . . . 0.0 111.219 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 4.4 m -81.03 -33.04 33.86 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.493 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.0 p -74.07 -69.22 0.46 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.67 -0.241 . . . . 0.0 111.532 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.7 ttt 54.14 81.41 0.1 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.872 0.368 . . . . 0.0 111.016 -179.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.6 ptpt -128.78 85.63 2.35 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.001 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.5 t 66.06 -179.83 0.2 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.384 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.7 mp -109.49 131.55 54.96 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.114 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.7 mtt85 -87.64 88.15 7.59 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.993 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 23.1 mt -122.39 127.31 75.06 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.132 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.931 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.634 HD12 ' HB2' ' A' ' 9' ' ' GLU . 0.6 OUTLIER -116.62 117.43 29.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.858 179.942 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.9 pp -96.2 127.97 42.69 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.804 0.335 . . . . 0.0 110.764 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.3 mp -112.79 147.51 36.76 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.353 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . 0.599 ' HA ' HD23 ' A' ' 40' ' ' LEU . 1.3 p -95.1 147.47 23.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.824 179.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 . . . . . 0 C--O 1.235 0.294 0 CA-C-N 116.227 -0.442 . . . . 0.0 112.03 -179.979 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.467 0.406 0 CA-C-O 120.955 0.407 . . . . 0.0 111.145 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 15.4 t -106.3 128.98 60.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.336 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -86.88 115.85 24.56 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.676 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.454 HG21 ' CZ ' ' A' ' 8' ' ' PHE . 20.1 mm -104.74 125.69 59.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.134 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.8 ttmt -100.92 116.15 32.11 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.636 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.454 ' CZ ' HG21 ' A' ' 6' ' ' ILE . 54.5 m-85 -109.55 132.61 53.97 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.717 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -119.51 133.61 55.6 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.196 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -141.11 116.11 9.84 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.81 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 34.8 m-20 56.05 35.66 25.99 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.339 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.45 -27.93 12.44 Favored Glycine 0 CA--C 1.525 0.677 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.963 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.55 150.16 47.35 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.715 0.257 . . . . 0.0 111.145 179.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.6 mtm-85 -125.75 143.82 50.89 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.397 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.23 132.36 16.34 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.165 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.5 mt -109.3 122.97 64.79 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.742 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 26.4 mt -133.08 130.18 57.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.122 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -97.54 131.18 44.38 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.098 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -112.96 117.04 30.97 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.745 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.85 140.1 47.37 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.846 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.47 150.91 95.68 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.978 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.74 132.44 26.91 Favored 'Cis proline' 0 C--N 1.35 0.606 0 C-N-CA 123.298 -1.543 . . . . 0.0 112.731 0.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.6 p -89.64 124.43 42.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.718 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.543 ' O ' HG23 ' A' ' 28' ' ' VAL . 6.4 mttt -113.21 134.47 54.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.941 -179.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -56.54 -46.46 80.65 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.076 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.22 -44.91 88.43 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.025 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -65.12 -44.67 87.96 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.304 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.543 HG23 ' O ' ' A' ' 24' ' ' LYS . 45.4 t -67.71 -47.26 80.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.777 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -59.71 -44.29 93.78 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.653 179.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.445 ' HA ' HG22 ' A' ' 33' ' ' THR . 3.7 t60 -57.89 -38.91 76.66 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.239 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.737 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.6 OUTLIER -69.82 -49.96 47.58 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.799 -0.182 . . . . 0.0 111.099 179.924 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.8 t -67.49 -43.33 87.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.445 HG22 ' HA ' ' A' ' 30' ' ' HIS . 5.9 t -59.8 -39.1 83.84 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.526 -179.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.3 m -72.12 -39.9 68.52 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 111.474 0.176 . . . . 0.0 111.474 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.737 HG23 ' O ' ' A' ' 31' ' ' LYS . 60.8 t -60.66 -55.75 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 120.508 0.194 . . . . 0.0 111.314 -179.524 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.539 ' CE2' HD11 ' A' ' 79' ' ' LEU . 40.9 m-85 -84.6 -20.06 32.04 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -179.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.4 178.22 41.38 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.6 -179.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -126.38 160.2 59.08 Favored Pre-proline 0 CA--C 1.53 0.201 0 CA-C-O 120.586 0.232 . . . . 0.0 110.85 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -83.82 146.34 52.36 Favored 'Cis proline' 0 C--N 1.351 0.686 0 C-N-CA 123.521 -1.45 . . . . 0.0 113.221 0.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.705 HD23 ' HA ' ' A' ' 81' ' ' SER . 17.3 mt -137.52 146.58 44.35 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.918 179.582 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -116.35 134.51 54.81 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.165 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.33 114.51 27.06 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.876 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -114.3 111.58 21.72 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.073 -179.516 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 16.8 t80 -93.4 121.9 35.26 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.276 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.1 ptt? -123.98 132.2 53.67 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.843 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -97.51 -47.89 5.49 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.358 179.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -163.72 -71.32 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.26 179.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -109.85 -25.72 10.17 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.453 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -103.6 140.74 37.14 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.76 0.314 . . . . 0.0 111.256 -179.607 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.3 m -112.37 132.25 55.11 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.698 179.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 30.0 mm -114.54 133.87 59.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.774 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.21 120.71 32.36 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.853 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.577 HD23 ' HB3' ' A' ' 58' ' ' ASP . 40.5 mt -104.61 125.27 50.58 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.57 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.2 ttmp? -128.5 -55.73 1.24 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.971 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.4 m-20 -104.53 174.58 5.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.792 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -58.98 -33.9 71.2 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.944 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.95 -48.53 67.28 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 120.579 0.228 . . . . 0.0 111.279 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.577 ' HB3' HD23 ' A' ' 53' ' ' LEU . 14.6 m-20 -63.26 -47.19 83.4 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.564 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 20.5 tp -63.43 -40.23 96.61 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.44 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -61.48 -43.3 99.1 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.607 -0.27 . . . . 0.0 110.813 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -34.72 78.76 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.814 179.291 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.99 -35.23 79.52 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.138 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 31.3 mm -59.64 -46.52 93.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.473 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -53.16 -43.51 67.09 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.849 179.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 32.3 mt -65.24 -43.15 95.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.311 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.461 HD21 ' O ' ' A' ' 74' ' ' SER . 0.1 OUTLIER -69.24 -48.09 62.85 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.886 0.374 . . . . 0.0 110.728 179.683 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.03 -40.33 76.52 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.6 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 37.3 ptt85 -69.02 -29.7 67.93 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 111.58 0.215 . . . . 0.0 111.58 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 64.7 p -76.12 116.75 17.13 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 120.732 0.301 . . . . 0.0 110.828 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 50.5 p -74.4 -48.97 24.49 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.246 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.17 -48.06 77.45 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.283 -179.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.06 145.64 49.77 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.016 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.9 mttp -136.66 -51.93 0.69 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.074 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.461 ' O ' HD21 ' A' ' 66' ' ' LEU . 0.7 OUTLIER -81.1 166.1 21.01 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.886 179.927 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -101.05 126.67 47.75 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.182 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.0 mtt180 -93.33 81.99 4.46 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.05 0.453 . . . . 0.0 110.851 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.3 mt -107.27 114.16 45.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.558 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.81 117.05 34.04 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.54 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.539 HD11 ' CE2' ' A' ' 36' ' ' PHE . 0.2 OUTLIER -104.72 135.89 45.26 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.881 179.91 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -139.97 154.7 47.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.83 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . 0.705 ' HA ' HD23 ' A' ' 40' ' ' LEU . 60.5 m -70.73 142.96 51.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.079 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.198 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 . . . . . 0 N--CA 1.489 1.493 0 CA-C-O 120.716 0.293 . . . . 0.0 111.045 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.0 m -126.48 156.82 40.11 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.071 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.4 t0 70.25 109.16 0.06 Allowed 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.055 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.9 t -94.91 116.37 36.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.269 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -87.25 115.42 24.63 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.735 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.512 HG12 HD13 ' A' ' 75' ' ' LEU . 22.7 mt -114.25 126.47 71.77 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.933 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.9 mtpt -100.65 115.45 30.24 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.873 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -101.58 138.93 37.93 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.025 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -122.44 128.17 50.55 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.962 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 25.2 t-80 -142.86 112.02 6.6 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.57 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 59.21 34.06 22.95 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.114 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.73 -31.01 6.82 Favored Glycine 0 CA--C 1.524 0.602 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.815 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -65.41 142.99 58.0 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.873 0.368 . . . . 0.0 111.151 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -119.71 143.55 47.71 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.362 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.92 134.89 30.65 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.948 179.617 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 22.1 mt -105.77 118.17 52.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.88 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.8 mt -128.33 129.9 69.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.179 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.46 147.44 23.54 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.2 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.402 ' CD2' HD12 ' A' ' 6' ' ' ILE . 13.0 m-85 -130.38 138.8 50.56 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.287 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.5 p -94.98 119.83 34.16 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.948 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.5 mtt180 -68.61 150.32 97.7 Favored Pre-proline 0 N--CA 1.464 0.254 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.893 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -72.72 144.43 80.77 Favored 'Cis proline' 0 C--N 1.35 0.623 0 C-N-CA 123.776 -1.343 . . . . 0.0 112.425 0.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.3 p -113.2 123.61 69.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.027 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.608 ' O ' HG23 ' A' ' 28' ' ' VAL . 3.7 mptt -101.01 137.52 39.27 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.048 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.713 ' HB2' HD22 ' A' ' 59' ' ' LEU . 66.0 t80 -54.78 -40.36 69.35 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.036 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -63.19 -45.31 92.34 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.973 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -64.37 -44.41 91.47 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.131 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.608 HG23 ' O ' ' A' ' 24' ' ' LYS . 26.3 t -62.46 -46.8 95.53 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.663 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.05 -46.07 85.97 Favored 'General case' 0 CA--C 1.528 0.111 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.038 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.05 -42.07 79.87 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 120.6 0.238 . . . . 0.0 111.246 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.787 ' O ' HG23 ' A' ' 35' ' ' VAL . 38.9 tttp -71.1 -49.8 40.47 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.25 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 28' ' ' VAL . 39.6 t -64.82 -41.53 92.42 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.765 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 54.9 m -58.81 -39.43 81.14 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.905 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.4 m -71.91 -36.81 70.09 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 121.369 -0.132 . . . . 0.0 111.258 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.787 HG23 ' O ' ' A' ' 31' ' ' LYS . 42.3 t -61.21 -55.18 26.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 N-CA-C 111.541 0.2 . . . . 0.0 111.541 -179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.641 ' CE2' HD21 ' A' ' 79' ' ' LEU . 71.4 m-85 -89.96 -19.68 24.21 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -178.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.431 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 105.07 179.24 24.24 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.301 -179.464 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -139.92 154.17 70.35 Favored Pre-proline 0 N--CA 1.464 0.271 0 O-C-N 122.819 -0.224 . . . . 0.0 110.914 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -85.84 148.73 44.04 Favored 'Cis proline' 0 C--N 1.351 0.684 0 C-N-CA 123.607 -1.414 . . . . 0.0 113.207 0.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.658 HD23 ' HA ' ' A' ' 81' ' ' SER . 20.0 mt -138.74 158.59 43.95 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.03 179.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -113.3 140.35 48.07 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.002 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.473 ' O ' HD13 ' A' ' 52' ' ' LEU . 12.9 mt -102.75 107.08 17.84 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.196 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -104.03 125.65 50.55 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.128 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -114.53 130.3 56.74 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.408 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 9.4 ptp -128.62 122.16 30.28 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.853 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 62.8 t30 -79.91 -59.7 2.63 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.462 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -175.03 -55.75 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.463 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -106.8 -26.32 11.32 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.551 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.3 mt -123.36 145.68 48.55 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.715 0.293 . . . . 0.0 111.248 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 56.1 p -120.82 132.78 55.2 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.811 179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mp -126.94 132.53 69.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.972 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.473 HD13 ' O ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -85.33 118.98 25.2 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.323 179.783 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 26.8 mt -65.89 105.73 1.38 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.945 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.0 mttp -110.88 -35.82 5.85 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.222 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -136.47 171.91 13.79 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.105 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -58.2 -29.94 66.07 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.119 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.438 ' HA ' ' OD2' ' A' ' 60' ' ' ASP . 1.2 m-20 -56.26 -43.5 78.79 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.116 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -66.89 -32.22 73.34 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.799 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.713 HD22 ' HB2' ' A' ' 25' ' ' TYR . 33.1 tp -64.86 -45.44 86.08 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.726 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.438 ' OD2' ' HA ' ' A' ' 57' ' ' ASP . 2.5 p30 -70.56 -31.85 69.03 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.577 0.227 . . . . 0.0 110.975 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -38.02 89.06 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.713 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.43 -42.98 86.92 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.2 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.3 mm -66.34 -41.69 89.36 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.156 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -55.15 -45.46 75.67 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.192 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.6 mt -66.57 -39.27 83.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.813 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 20.0 tp -64.56 -43.67 93.2 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.877 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -57.16 -42.68 81.55 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.069 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.71 -31.95 72.96 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.073 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 27.5 t -79.03 146.18 33.46 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.128 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.63 -18.75 62.18 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.541 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 60.3 p -93.57 38.2 1.06 Allowed 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.756 0.312 . . . . 0.0 111.554 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.35 84.71 4.51 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.639 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp -138.93 -58.99 0.6 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.929 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.1 p -112.99 168.22 9.87 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.041 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.512 HD13 HG12 ' A' ' 6' ' ' ILE . 5.5 mp -122.62 138.81 54.48 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.038 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 7.4 ttp180 -97.31 87.57 4.19 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.982 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.1 mt -117.68 118.2 57.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.691 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.3 tt -108.52 128.65 54.99 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.178 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.641 HD21 ' CE2' ' A' ' 36' ' ' PHE . 3.5 pp -113.76 136.61 52.67 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.846 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -135.6 148.19 48.95 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.163 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.658 ' HA ' HD23 ' A' ' 40' ' ' LEU . 2.6 p -72.65 147.39 45.81 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.391 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -78.81 3.41 16.84 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -179.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.3 t70 62.96 127.38 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.098 0.559 . . . . 0.0 112.059 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.5 mtt85 72.28 125.81 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.004 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.3 p-10 -105.97 155.8 19.01 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.557 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.3 mp -107.29 100.52 9.96 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.18 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -160.23 63.32 0.34 Allowed 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.043 0.449 . . . . 0.0 111.205 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.88 165.3 17.89 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.457 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -120.42 -69.47 0.84 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.566 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 16.7 p80 -159.6 156.84 28.68 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.962 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -161.16 155.32 22.73 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.901 0.381 . . . . 0.0 111.385 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -71.17 146.56 49.04 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.902 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.081 -0.962 . . . . 0.0 111.346 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 120.586 0.232 . . . . 0.0 111.194 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.433 ' O ' ' HA ' ' A' ' 20' ' ' SER . 1.4 m 58.3 81.49 0.15 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.174 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -171.96 94.42 0.15 Allowed 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.987 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 22.2 t -96.08 123.19 48.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.888 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.7 mtt180 -87.29 114.81 24.23 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.951 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.491 HG21 HD12 ' A' ' 77' ' ' ILE . 23.7 mt -105.9 118.51 53.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.827 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -103.65 114.7 29.16 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.363 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.513 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 0.9 OUTLIER -117.6 145.53 44.25 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.921 -179.774 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -119.21 139.88 51.12 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.615 -179.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.52 ' HB2' HD11 ' A' ' 79' ' ' LEU . 24.5 t-80 -141.02 114.65 8.89 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.364 179.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 51.3 m-20 57.63 33.47 23.29 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.657 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.14 -47.0 1.14 Allowed Glycine 0 C--N 1.336 0.545 0 C-N-CA 120.863 -0.684 . . . . 0.0 113.36 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.24 145.39 51.39 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.815 0.34 . . . . 0.0 110.997 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 ptp180 -124.1 147.66 47.74 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.622 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.513 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -131.02 137.33 49.14 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.749 179.641 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 19.1 mt -117.41 126.32 74.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.908 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 28.0 mt -138.98 131.6 37.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.957 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.37 145.73 24.72 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.179 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -131.13 125.36 32.89 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.116 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.433 ' HA ' ' O ' ' A' ' 2' ' ' SER . 40.7 t -71.39 126.68 30.29 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.007 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 25.6 mtt85 -71.6 144.91 89.3 Favored Pre-proline 0 CA--C 1.53 0.192 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.031 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -77.38 123.12 9.2 Favored 'Cis proline' 0 C--N 1.349 0.581 0 C-N-CA 123.193 -1.586 . . . . 0.0 112.612 -0.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.3 p -72.27 145.4 12.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.058 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.576 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.5 mmmt -111.38 132.28 54.55 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.259 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.401 ' HD1' HD13 ' A' ' 59' ' ' LEU . 64.4 t80 -57.46 -43.29 83.88 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.895 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -59.19 -43.56 92.21 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.167 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.402 ' HB2' ' HB2' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -65.7 -44.57 85.74 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.346 -179.955 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.576 HG23 ' O ' ' A' ' 24' ' ' LYS . 23.7 t -65.39 -47.97 84.9 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.738 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.51 ' HG2' HD11 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -63.67 -46.14 86.92 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.345 179.912 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 67.2 t60 -56.38 -41.01 75.51 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.535 0.207 . . . . 0.0 111.443 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.78 ' O ' HG23 ' A' ' 35' ' ' VAL . 8.4 tttp -71.05 -49.79 40.97 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.341 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 28' ' ' VAL . 46.5 t -66.4 -43.01 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.602 -179.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 53.4 m -59.05 -39.24 81.42 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.314 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.5 m -72.2 -36.69 69.26 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.399 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.78 HG23 ' O ' ' A' ' 31' ' ' LYS . 57.0 t -62.34 -51.6 70.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -95.59 -18.09 20.85 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -178.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.679 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 105.93 -177.51 22.58 Favored Glycine 0 CA--C 1.523 0.557 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.599 -179.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.411 ' HB2' ' HA ' ' A' ' 39' ' ' PRO . 7.6 pm0 -134.08 155.43 80.07 Favored Pre-proline 0 N--CA 1.463 0.219 0 O-C-N 122.776 -0.249 . . . . 0.0 111.098 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.411 ' HA ' ' HB2' ' A' ' 38' ' ' GLN . 83.4 Cg_endo -90.0 145.1 17.82 Favored 'Cis proline' 0 C--N 1.348 0.508 0 C-N-CA 123.651 -1.396 . . . . 0.0 113.101 0.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.679 HD12 ' O ' ' A' ' 37' ' ' GLY . 23.2 mt -138.49 139.87 38.96 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.831 179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -112.4 140.28 47.27 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.092 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.51 HD11 ' HG2' ' A' ' 29' ' ' GLU . 3.7 mt -87.45 113.97 23.63 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.036 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -106.04 117.54 34.28 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.014 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.403 ' HB3' HD23 ' A' ' 53' ' ' LEU . 14.2 t80 -107.17 122.84 47.31 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 120.783 0.325 . . . . 0.0 110.697 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 28.2 mtp -110.62 128.17 55.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.431 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -71.3 -56.42 6.05 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.711 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -178.86 -52.99 0.01 OUTLIER 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.329 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -104.73 -29.73 10.38 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.53 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -119.68 160.35 22.69 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.876 0.37 . . . . 0.0 111.522 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.5 m -104.64 132.33 51.02 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.988 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 25.1 mm -116.02 133.45 62.44 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.916 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.0 mt -104.4 125.15 50.35 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.89 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.403 HD23 ' HB3' ' A' ' 44' ' ' TYR . 0.9 OUTLIER -119.59 106.13 11.88 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.398 179.924 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -107.77 -34.43 6.97 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.137 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -98.23 166.11 11.56 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.626 0.25 . . . . 0.0 110.825 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.06 -35.64 80.93 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.04 179.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -52.84 -47.05 68.02 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.141 179.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.4 -31.66 72.56 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.177 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.401 HD13 ' HD1' ' A' ' 25' ' ' TYR . 6.0 tp -72.69 -39.03 67.34 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.68 -0.236 . . . . 0.0 110.552 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.86 -43.5 98.71 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.268 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -66.63 -38.84 87.77 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.818 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.31 -45.0 93.38 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.562 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 14.1 mt -66.37 -41.13 88.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.894 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -55.08 -44.96 75.33 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.039 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.3 mt -64.82 -43.11 96.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.733 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.753 HD12 ' HB3' ' A' ' 72' ' ' MET . 9.2 tp -62.01 -47.3 85.39 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.129 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.97 -37.49 87.84 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.668 -0.242 . . . . 0.0 111.246 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.4 tpt180 -72.61 -35.27 67.82 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.069 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.0 t -76.39 128.26 34.47 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.39 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 27.9 p -75.09 -38.43 61.22 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.826 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.74 -47.16 32.74 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.171 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.753 ' HB3' HD12 ' A' ' 66' ' ' LEU . 1.8 mpp? -78.79 91.76 4.76 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.113 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.9 mtpt -97.0 -45.81 6.44 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.184 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.465 ' O ' HD11 ' A' ' 66' ' ' LEU . 2.8 p -91.0 151.2 21.15 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.902 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.699 ' HG ' HD22 ' A' ' 66' ' ' LEU . 0.2 OUTLIER -91.98 124.15 35.87 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.01 -179.955 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -93.68 88.9 6.0 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.878 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.491 HD12 HG21 ' A' ' 6' ' ' ILE . 31.1 mt -111.93 117.66 55.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.583 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.589 HD23 HD11 ' A' ' 80' ' ' LEU . 4.9 tp -102.06 123.69 46.37 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.852 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.52 HD11 ' HB2' ' A' ' 10' ' ' HIS . 2.3 pp -112.07 130.99 55.7 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.778 179.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.589 HD11 HD23 ' A' ' 78' ' ' LEU . 0.4 OUTLIER -131.5 142.69 50.01 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.988 -179.439 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -86.51 143.79 27.55 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.859 179.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.59 5.05 47.36 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.971 -0.558 . . . . 0.0 112.1 179.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 61.33 173.72 0.11 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.82 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -119.12 91.18 3.49 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.173 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -90.66 -174.73 4.18 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.038 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.78 62.31 7.38 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 120.854 0.359 . . . . 0.0 111.42 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -151.86 25.68 0.65 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.409 179.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 12.5 m80 -115.67 -23.98 8.46 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.58 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 65.55 74.62 0.37 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.786 0.327 . . . . 0.0 111.099 179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -137.56 -72.58 0.42 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.511 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -177.19 177.35 1.24 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.841 0.353 . . . . 0.0 110.907 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -148.84 -55.69 0.2 Allowed 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.74 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 14.3 p80 . . . . . 0 C--O 1.251 1.149 0 CA-C-O 118.355 -0.831 . . . . 0.0 111.216 179.833 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 120.811 0.339 . . . . 0.0 111.125 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.3 m -151.72 99.57 2.6 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.153 -179.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -170.1 89.83 0.17 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.162 0.506 . . . . 0.0 111.359 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 23.1 t -90.42 116.38 31.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.926 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.6 mtt180 -90.06 121.79 32.46 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.744 0.307 . . . . 0.0 111.049 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.534 HG23 ' HB2' ' A' ' 75' ' ' LEU . 2.6 mt -115.57 130.06 70.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.989 179.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.4 tttm -95.45 126.89 41.06 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.699 179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -117.1 136.25 53.14 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.282 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.728 ' HB3' HD12 ' A' ' 78' ' ' LEU . 1.6 mt-10 -121.96 127.54 50.47 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.074 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.6 t-80 -131.13 112.57 12.98 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.686 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 55.67 34.76 23.92 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.523 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 98.69 -35.42 4.64 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.686 -179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.79 136.58 57.07 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.716 0.293 . . . . 0.0 110.817 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.13 145.29 41.19 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.621 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.63 130.2 13.97 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.087 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.9 mp -102.49 125.8 56.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.808 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.6 mt -130.38 134.29 62.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.219 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.27 138.8 31.22 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.248 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.492 ' CD1' HD12 ' A' ' 6' ' ' ILE . 38.5 m-85 -130.78 117.4 19.32 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.76 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.1 m -76.85 143.34 39.77 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.728 0.299 . . . . 0.0 111.188 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.5 mtm105 -96.05 154.98 38.75 Favored Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.125 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_exo -73.12 142.44 74.76 Favored 'Cis proline' 0 C--N 1.349 0.597 0 C-N-CA 123.57 -1.429 . . . . 0.0 112.335 -0.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.5 p -128.41 147.58 32.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.944 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.483 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -115.97 143.96 44.73 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.007 -179.875 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.554 ' OH ' HD12 ' A' ' 42' ' ' LEU . 64.3 t80 -56.52 -36.95 69.8 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.285 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.87 -44.93 91.19 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.9 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.44 ' HB2' ' HG2' ' A' ' 24' ' ' LYS . 8.7 t0 -69.63 -44.3 70.9 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.007 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.689 ' O ' HG23 ' A' ' 32' ' ' VAL . 38.7 t -64.52 -46.16 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.866 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -58.65 -42.19 87.81 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.286 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -57.42 -46.1 83.88 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.742 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.714 ' O ' HG23 ' A' ' 35' ' ' VAL . 18.5 tttp -70.18 -48.78 55.77 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.943 179.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.689 HG23 ' O ' ' A' ' 28' ' ' VAL . 44.4 t -58.81 -42.37 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-N 116.76 -0.2 . . . . 0.0 111.318 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 86.4 m -64.19 -39.58 94.3 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.056 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 60.1 m -72.47 -42.72 64.63 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.449 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.714 HG23 ' O ' ' A' ' 31' ' ' LYS . 57.5 t -61.98 -51.37 73.34 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.405 ' CE2' HD21 ' A' ' 79' ' ' LEU . 41.7 m-85 -87.81 -20.95 25.39 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -179.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.405 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 103.49 -175.72 23.76 Favored Glycine 0 C--N 1.337 0.631 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.676 -179.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -144.32 155.46 57.73 Favored Pre-proline 0 N--CA 1.465 0.316 0 CA-C-O 120.528 0.204 . . . . 0.0 111.01 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -84.09 137.63 28.16 Favored 'Cis proline' 0 C--N 1.35 0.641 0 C-N-CA 123.546 -1.439 . . . . 0.0 113.205 0.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.687 HD23 ' HA ' ' A' ' 81' ' ' SER . 97.8 mt -137.18 130.41 31.02 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.744 179.488 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -105.09 139.86 39.13 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.729 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.622 HD23 ' HB3' ' A' ' 79' ' ' LEU . 64.7 mt -92.16 108.53 20.01 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.808 0.337 . . . . 0.0 110.94 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -109.36 117.74 34.83 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.495 -179.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.745 ' HB2' HD11 ' A' ' 53' ' ' LEU . 12.4 t80 -96.1 124.52 40.14 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.392 179.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 53.4 mtp -117.56 125.87 51.57 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.542 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.1 t30 -87.48 -52.61 5.26 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.777 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -173.58 -62.55 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.369 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -108.82 -25.55 10.73 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.565 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -111.93 149.33 32.07 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-O 120.823 0.344 . . . . 0.0 111.147 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.6 m -113.22 131.15 56.01 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.978 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.8 mt -121.63 133.99 66.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.909 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.9 mp -105.34 124.65 49.9 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.709 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.745 HD11 ' HB2' ' A' ' 44' ' ' TYR . 1.2 mp -91.81 92.61 8.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.721 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 42.8 mttm -111.17 30.44 6.9 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.134 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -175.97 167.39 3.02 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.912 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -63.13 -38.95 93.22 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.311 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.36 -44.45 80.14 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.338 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -64.78 -46.16 83.27 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.001 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 33.0 tp -61.26 -41.25 96.58 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.664 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -61.17 -43.09 99.43 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.575 179.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.3 mttm -65.31 -38.67 90.92 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.011 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.54 -41.35 98.82 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.015 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 18.8 mt -64.9 -43.84 96.25 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.081 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.662 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.67 -45.06 73.83 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.206 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 41.5 mt -68.36 -45.24 82.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.353 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.628 HD13 ' C ' ' A' ' 66' ' ' LEU . 1.5 tm? -65.92 -48.05 72.7 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.041 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.401 ' N ' HD13 ' A' ' 66' ' ' LEU . 1.9 t70 -60.2 -41.77 93.67 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.296 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -74.15 -31.65 62.81 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.66 -179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 76.9 p -80.91 112.07 17.96 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.6 0.238 . . . . 0.0 110.663 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 53.0 m -71.43 -30.32 65.91 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.062 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.16 -34.09 71.68 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.587 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 5.9 ttm -111.61 140.97 45.79 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.649 0.261 . . . . 0.0 111.053 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.4 mttt -115.46 -44.36 2.98 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.118 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 67.5 m -100.46 170.98 8.03 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.745 179.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.534 ' HB2' HG23 ' A' ' 6' ' ' ILE . 0.7 OUTLIER -91.87 120.6 32.71 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.786 179.941 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 6.0 mmt85 -91.76 73.98 5.78 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.537 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 36.0 mt -111.34 124.71 68.37 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.833 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.728 HD12 ' HB3' ' A' ' 9' ' ' GLU . 4.9 tp -102.08 119.63 39.11 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.863 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.622 ' HB3' HD23 ' A' ' 42' ' ' LEU . 2.0 pp -106.86 125.07 50.53 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.888 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.435 ' O ' HD12 ' A' ' 80' ' ' LEU . 1.0 OUTLIER -116.8 162.75 17.21 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.282 179.941 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.687 ' HA ' HD23 ' A' ' 40' ' ' LEU . 40.6 t -88.21 137.4 32.36 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.993 179.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 10.8 tp60 -87.39 5.7 37.41 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.687 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -85.03 179.58 7.25 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.912 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -116.29 34.39 5.04 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.265 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -97.78 87.23 3.97 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.947 0.404 . . . . 0.0 111.057 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.9 tt -153.57 90.25 1.39 Allowed 'General case' 0 C--O 1.235 0.337 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.037 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -142.99 91.78 2.33 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.861 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.4 m-70 -126.8 -49.53 1.49 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.237 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -172.31 -37.98 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.351 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 23.9 m170 -51.99 100.67 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 120.807 0.337 . . . . 0.0 111.008 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -155.37 -59.02 0.1 Allowed 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.773 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 62.93 -175.24 0.15 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.499 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 . . . . . 0 C--O 1.251 1.155 0 CA-C-O 118.535 -0.745 . . . . 0.0 111.366 179.974 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.507 0 CA-C-O 120.669 0.271 . . . . 0.0 111.211 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.5 p -124.6 145.02 49.84 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.12 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 69.86 114.04 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.205 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.8 t -86.06 110.48 19.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.982 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.26 108.8 19.11 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.688 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 19.5 mt -109.54 128.45 65.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.837 0.351 . . . . 0.0 111.44 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -101.35 123.4 45.38 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.828 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.619 ' CZ ' HG21 ' A' ' 32' ' ' VAL . 84.7 m-85 -115.03 139.88 49.51 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.041 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -124.26 125.44 44.39 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.959 0.409 . . . . 0.0 111.102 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.4 t-80 -138.25 124.02 19.89 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.513 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 57.64 32.07 21.31 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.29 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.36 -41.38 2.59 Favored Glycine 0 C--N 1.337 0.607 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.816 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -68.87 152.25 45.54 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 120.778 0.323 . . . . 0.0 111.332 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.15 151.43 35.67 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.186 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.3 mtt85 -128.5 127.51 42.56 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.736 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.511 ' O ' HD13 ' A' ' 17' ' ' ILE . 2.8 mt -98.18 117.02 42.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.747 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.511 HD13 ' O ' ' A' ' 16' ' ' ILE . 25.5 mm -131.2 133.42 62.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-O 120.826 0.346 . . . . 0.0 111.068 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -107.41 136.88 46.47 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.047 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.437 ' CZ ' ' HA ' ' A' ' 28' ' ' VAL . 8.5 m-85 -121.24 126.93 50.81 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.5 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -82.33 150.13 27.37 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.98 179.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.8 mtt-85 -87.63 143.11 33.35 Favored Pre-proline 0 N--CA 1.463 0.192 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.87 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -78.92 166.54 79.06 Favored 'Cis proline' 0 C--N 1.352 0.753 0 C-N-CA 123.661 -1.391 . . . . 0.0 112.766 0.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.5 p -146.85 139.49 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.099 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -114.65 159.79 20.07 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.681 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.475 ' CD1' HD13 ' A' ' 59' ' ' LEU . 37.6 t80 -55.53 -40.62 72.06 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.666 -0.243 . . . . 0.0 110.958 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.12 -43.43 91.94 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.009 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -63.02 -44.64 95.37 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.987 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.609 ' O ' HG23 ' A' ' 32' ' ' VAL . 41.1 t -68.0 -47.7 77.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.907 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -64.01 -44.91 91.16 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.172 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -56.4 -43.45 79.33 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.421 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.798 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.5 OUTLIER -69.35 -49.33 56.62 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.096 179.878 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.619 HG21 ' CZ ' ' A' ' 8' ' ' PHE . 47.6 t -63.13 -44.84 99.64 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.511 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 90.4 m -58.42 -39.37 79.58 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.982 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 28.5 m -72.27 -40.8 67.37 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 121.186 -0.206 . . . . 0.0 111.303 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.798 HG23 ' O ' ' A' ' 31' ' ' LYS . 58.9 t -56.83 -51.85 62.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 120.558 0.218 . . . . 0.0 111.553 -179.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.666 ' CE2' HD21 ' A' ' 79' ' ' LEU . 81.6 m-85 -90.37 -27.4 19.38 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.115 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.736 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 102.44 -160.12 17.5 Favored Glycine 0 C--N 1.336 0.536 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.577 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -144.88 158.46 52.71 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 120.446 0.165 . . . . 0.0 110.868 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -87.5 131.77 12.07 Favored 'Cis proline' 0 C--N 1.346 0.427 0 C-N-CA 123.649 -1.396 . . . . 0.0 113.055 0.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.736 HD12 ' O ' ' A' ' 37' ' ' GLY . 17.9 mt -136.71 147.71 46.92 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.089 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -114.55 130.17 56.73 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.991 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.438 HD21 HG11 ' A' ' 32' ' ' VAL . 3.5 mt -87.8 110.07 20.21 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.873 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.44 ' CD2' ' HB3' ' A' ' 50' ' ' SER . 0.1 OUTLIER -115.41 119.46 36.32 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.495 -179.67 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.796 ' HB3' HD21 ' A' ' 53' ' ' LEU . 12.7 t80 -98.59 130.44 45.13 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.867 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -101.95 131.02 48.59 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.642 179.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -77.99 -40.12 40.17 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.786 0.327 . . . . 0.0 110.797 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -174.48 -54.51 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.202 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -112.8 -41.08 3.85 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.353 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -100.36 165.94 11.21 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.995 0.426 . . . . 0.0 111.388 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.44 ' HB3' ' CD2' ' A' ' 43' ' ' HIS . 2.5 m -121.29 122.25 39.49 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.763 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -114.15 131.78 65.13 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.184 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.11 135.07 34.55 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.709 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.796 HD21 ' HB3' ' A' ' 44' ' ' TYR . 0.5 OUTLIER -98.42 86.64 3.66 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.456 179.85 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -99.55 24.57 8.04 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.672 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -166.08 160.05 16.01 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.588 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.8 -40.82 89.64 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.73 0.3 . . . . 0.0 110.394 179.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -61.94 -46.25 90.11 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.984 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -60.67 -44.33 96.6 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.882 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.475 HD13 ' CD1' ' A' ' 25' ' ' TYR . 4.7 tp -63.01 -42.96 99.97 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.111 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -69.45 -34.84 74.99 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.277 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.0 ttpt -62.39 -37.01 84.09 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.863 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.77 -37.86 89.05 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.991 179.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 33.2 mm -63.75 -43.92 98.14 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.19 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -53.9 -36.48 62.76 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.053 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.8 mt -66.63 -40.11 85.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.819 179.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 26.2 tp -62.39 -40.06 95.26 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.118 179.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.19 -34.36 68.43 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.3 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.0 -34.51 76.64 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.898 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.4 t -81.61 97.93 8.1 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.048 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.3 p -63.69 -33.76 76.36 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.404 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.8 p -71.16 -49.31 45.25 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.246 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.9 ttm -67.89 147.21 52.81 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.075 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.28 -48.34 0.59 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.31 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -78.41 171.11 15.57 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.706 0.289 . . . . 0.0 110.842 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.449 ' HB3' HD11 ' A' ' 77' ' ' ILE . 4.0 mm? -102.36 118.25 36.48 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.744 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -92.16 84.04 5.19 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.777 0.322 . . . . 0.0 110.93 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.449 HD11 ' HB3' ' A' ' 75' ' ' LEU . 2.9 mt -109.29 128.56 65.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.004 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.518 HD12 HD11 ' A' ' 80' ' ' LEU . 0.5 OUTLIER -113.36 123.8 50.96 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.32 -179.844 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.666 HD21 ' CE2' ' A' ' 36' ' ' PHE . 2.8 pp -112.97 131.48 55.74 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.696 179.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.518 HD11 HD12 ' A' ' 78' ' ' LEU . 1.7 mp -121.09 151.22 40.1 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.241 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.473 ' HA ' HD23 ' A' ' 40' ' ' LEU . 2.5 t -98.14 147.41 24.6 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.119 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.93 5.82 44.71 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.651 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -89.04 89.4 7.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.962 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 18.2 mtp180 66.11 104.41 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.355 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 32.2 t30 -129.19 155.85 44.86 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.217 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.1 tp -112.97 166.12 11.7 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.915 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -66.81 -67.94 0.41 Allowed 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.861 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -175.53 114.64 0.14 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.915 0.388 . . . . 0.0 111.094 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -148.16 155.8 41.84 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.164 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 60.3 30.88 20.2 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.061 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 6.8 t-160 -142.82 77.54 1.58 Allowed 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.49 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 33.8 m80 -126.69 136.96 53.16 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.04 -179.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 16.1 t-80 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.435 -0.793 . . . . 0.0 111.088 -179.881 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 120.902 0.382 . . . . 0.0 111.366 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.38 79.24 5.62 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.122 0.487 . . . . 0.0 110.927 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.504 ' HB2' ' HB1' ' A' ' 18' ' ' ALA . 14.4 p-10 -95.61 100.95 12.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.205 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 32.2 t -75.77 129.63 36.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.973 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -87.81 112.06 22.05 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.78 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.418 ' HA ' ' HB2' ' A' ' 75' ' ' LEU . 19.8 mt -99.11 125.9 52.49 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.02 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.0 mttt -99.33 117.67 34.28 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.8 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.449 ' CD1' HD12 ' A' ' 17' ' ' ILE . 80.0 m-85 -107.37 145.72 32.52 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.036 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -125.9 126.1 43.87 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.13 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.0 t-160 -141.27 116.94 10.31 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.567 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 16.0 m120 57.21 34.92 25.52 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.236 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.94 -38.34 3.17 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.864 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -65.3 150.81 47.62 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.759 0.314 . . . . 0.0 111.291 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.58 157.14 37.88 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.357 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.2 142.28 24.92 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.056 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.3 mp -114.59 119.56 61.87 Favored 'Isoleucine or valine' 0 C--O 1.232 0.176 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.941 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.449 HD12 ' CD1' ' A' ' 8' ' ' PHE . 3.1 mt -127.12 130.79 71.16 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.038 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.504 ' HB1' ' HB2' ' A' ' 3' ' ' ASP . . . -94.11 143.42 26.38 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.434 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.403 ' CD2' HD12 ' A' ' 6' ' ' ILE . 44.8 m-85 -137.6 117.08 12.86 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.903 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 27.9 p -72.69 143.21 48.16 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.083 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.82 153.92 37.65 Favored Pre-proline 0 C--O 1.232 0.171 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.305 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -74.53 140.57 68.02 Favored 'Cis proline' 0 C--N 1.351 0.706 0 C-N-CA 123.54 -1.442 . . . . 0.0 112.528 0.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.9 p -127.01 143.67 39.71 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.048 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.64 142.48 27.3 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.062 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 50.3 t80 -59.58 -36.99 77.31 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.209 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.56 -45.0 89.89 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.995 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -63.05 -44.58 95.48 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.157 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.693 ' O ' HG23 ' A' ' 32' ' ' VAL . 24.9 t -67.05 -46.7 84.0 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.935 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.444 ' HG2' HD11 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -58.64 -45.2 89.81 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.169 179.916 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -56.78 -46.77 81.29 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.761 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.755 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.3 OUTLIER -67.06 -49.83 63.81 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.3 179.784 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.693 HG23 ' O ' ' A' ' 28' ' ' VAL . 47.4 t -58.48 -43.29 86.52 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.335 -179.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 95.4 m -62.8 -39.45 94.3 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.02 179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 39.0 m -72.08 -42.86 65.68 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 121.254 -0.178 . . . . 0.0 111.425 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.755 HG23 ' O ' ' A' ' 31' ' ' LYS . 59.7 t -56.57 -51.91 59.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-O 120.54 0.21 . . . . 0.0 111.533 -179.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.537 ' CE2' HD21 ' A' ' 79' ' ' LEU . 76.7 m-85 -88.32 -28.21 21.18 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.303 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.66 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 101.73 -159.95 18.17 Favored Glycine 0 C--N 1.334 0.442 0 C-N-CA 121.0 -0.619 . . . . 0.0 112.347 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.76 156.15 55.98 Favored Pre-proline 0 N--CA 1.464 0.244 0 CA-C-O 120.437 0.16 . . . . 0.0 110.787 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -88.07 131.35 10.97 Favored 'Cis proline' 0 C--N 1.35 0.639 0 C-N-CA 123.559 -1.434 . . . . 0.0 112.939 0.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.66 HD12 ' O ' ' A' ' 37' ' ' GLY . 6.4 mt -138.34 130.55 28.7 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.138 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -101.64 135.2 43.56 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.019 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.444 HD11 ' HG2' ' A' ' 29' ' ' GLU . 9.3 mt -91.27 104.16 16.74 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.781 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -106.48 129.71 54.4 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.27 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -106.1 119.32 38.91 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.582 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.414 ' O ' ' HD2' ' A' ' 76' ' ' ARG . 5.3 mtt -131.76 140.01 49.11 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.933 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 -99.35 -45.98 5.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.775 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -172.95 -64.11 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.486 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -108.82 -30.83 7.95 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.464 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.3 mt -93.73 132.58 37.95 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.716 0.293 . . . . 0.0 111.227 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 94.8 p -112.1 122.58 48.15 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.798 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.0 mp -127.5 132.72 69.01 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.032 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.526 HD23 ' N ' ' A' ' 53' ' ' LEU . 1.9 tt -102.96 131.17 50.11 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.515 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.526 ' N ' HD23 ' A' ' 52' ' ' LEU . 12.1 mt -74.52 84.75 2.03 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.085 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.2 tptt -77.86 -37.61 47.89 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.977 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -145.23 -179.24 6.51 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.139 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -57.47 -35.09 69.71 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.842 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.24 -46.18 79.69 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.963 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -60.45 -41.61 94.44 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.711 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.7 tp -63.42 -43.45 97.45 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.125 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.46 -41.11 98.52 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.254 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.04 -35.75 81.27 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.684 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.96 -38.34 90.71 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.166 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.6 mm -63.89 -42.43 95.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.083 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -56.71 -39.46 73.91 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.035 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 47.6 mt -68.36 -40.48 82.47 Favored 'Isoleucine or valine' 0 C--O 1.232 0.156 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.046 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.717 HD11 ' HG ' ' A' ' 75' ' ' LEU . 92.8 mt -61.05 -46.9 88.82 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.061 179.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.91 -31.34 70.86 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.176 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.7 mmt180 -66.94 -28.02 67.94 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.257 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.8 t -59.75 148.49 34.08 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.872 0.367 . . . . 0.0 111.502 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.07 -35.52 71.93 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.234 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -158.36 93.25 1.2 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.996 0.427 . . . . 0.0 111.754 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -167.22 107.83 0.61 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.053 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -99.28 -31.89 11.47 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.341 179.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.87 165.03 25.7 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.744 0.307 . . . . 0.0 111.372 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.717 ' HG ' HD11 ' A' ' 66' ' ' LEU . 0.5 OUTLIER -110.27 131.66 54.86 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.281 -179.915 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.414 ' HD2' ' O ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -87.18 78.95 8.74 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.936 179.86 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.618 HD11 HD23 ' A' ' 75' ' ' LEU . 32.7 mm -104.01 113.58 41.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.607 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.55 HD21 HD21 ' A' ' 80' ' ' LEU . 6.4 tt -110.77 117.15 32.66 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.861 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.537 HD21 ' CE2' ' A' ' 36' ' ' PHE . 2.5 pp -112.33 130.61 55.9 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.874 0.368 . . . . 0.0 110.967 179.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.55 HD21 HD21 ' A' ' 78' ' ' LEU . 0.4 OUTLIER -121.64 156.94 31.93 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.204 -179.747 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 6.1 t -83.01 147.65 28.04 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.779 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 33.2 tp60 -84.55 5.96 25.65 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.915 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -89.66 117.98 28.94 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.193 -179.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 67.73 100.16 0.05 Allowed 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.348 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -142.26 75.38 1.49 Allowed 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.021 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 55.91 73.53 0.43 Allowed 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.088 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -157.43 -50.27 0.07 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.357 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -82.88 141.5 32.18 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.044 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 23.3 m80 62.5 75.99 0.38 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.198 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 12.3 t-160 -138.73 101.1 4.24 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.947 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -126.15 120.31 29.79 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.437 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 21.9 p80 -105.36 133.52 49.98 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.266 -179.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.094 -0.955 . . . . 0.0 111.537 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 120.786 0.327 . . . . 0.0 111.091 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m -117.53 160.0 21.95 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.638 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 60.87 80.21 0.22 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.896 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 25.4 t -86.18 145.04 8.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.424 -179.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.8 ttt180 -93.49 106.41 18.38 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.017 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 25.2 mt -104.69 125.96 59.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.071 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.0 mttm -103.93 129.47 51.48 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.596 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -111.83 131.55 55.27 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.859 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.445 ' HG3' ' HG3' ' A' ' 14' ' ' ARG . 24.7 tt0 -119.39 130.01 55.09 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.819 0.342 . . . . 0.0 111.116 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.7 t-160 -141.07 121.0 13.59 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.694 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 61.07 26.2 16.16 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.604 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.36 -46.96 1.14 Allowed Glycine 0 C--N 1.338 0.644 0 C-N-CA 120.912 -0.661 . . . . 0.0 113.415 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -66.02 139.58 58.22 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.925 0.362 . . . . 0.0 111.275 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.445 ' HG3' ' HG3' ' A' ' 9' ' ' GLU . 2.6 mtt85 -108.91 155.25 21.05 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.419 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.1 149.22 50.0 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.926 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.45 ' O ' HD13 ' A' ' 17' ' ' ILE . 34.3 mt -115.32 117.68 56.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.078 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.45 HD13 ' O ' ' A' ' 16' ' ' ILE . 21.2 mm -131.57 136.49 57.17 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.257 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -94.53 141.32 28.74 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.992 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -128.91 117.1 20.43 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.937 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 37.8 t -86.29 140.84 29.71 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.89 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -84.79 157.53 60.46 Favored Pre-proline 0 CA--C 1.531 0.25 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.025 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.75 157.48 99.52 Favored 'Cis proline' 0 C--N 1.35 0.628 0 C-N-CA 123.486 -1.464 . . . . 0.0 112.77 0.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.7 p -139.25 139.25 39.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.196 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.577 ' O ' HG23 ' A' ' 28' ' ' VAL . 9.3 mptt -119.47 154.61 33.5 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.719 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.45 ' CD1' HD11 ' A' ' 59' ' ' LEU . 23.1 t80 -54.35 -45.13 72.65 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.85 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.43 -41.94 99.09 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.16 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -62.58 -44.24 96.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.987 -179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.654 ' O ' HG23 ' A' ' 32' ' ' VAL . 20.4 t -67.7 -43.25 86.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.793 179.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.81 -45.37 86.2 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.442 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.74 -42.75 99.38 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.315 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.789 ' O ' HG23 ' A' ' 35' ' ' VAL . 7.8 tmtt? -69.92 -49.72 49.24 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.267 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.654 HG23 ' O ' ' A' ' 28' ' ' VAL . 47.6 t -61.55 -40.91 88.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 CA-C-N 116.663 -0.244 . . . . 0.0 111.476 -179.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.726 HG23 ' HG3' ' A' ' 38' ' ' GLN . 22.3 m -58.62 -41.26 85.49 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.088 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 34.8 m -72.56 -37.39 68.24 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 111.524 0.194 . . . . 0.0 111.524 179.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.789 HG23 ' O ' ' A' ' 31' ' ' LYS . 47.1 t -61.23 -52.7 58.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 N-CA-C 111.876 0.325 . . . . 0.0 111.876 -179.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -98.16 -15.85 19.75 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -178.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.401 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 95.14 -156.9 21.88 Favored Glycine 0 C--N 1.334 0.457 0 C-N-CA 120.598 -0.81 . . . . 0.0 112.349 -179.28 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.726 ' HG3' HG23 ' A' ' 33' ' ' THR . 0.9 OUTLIER -144.74 158.48 53.14 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.456 0.169 . . . . 0.0 111.056 179.915 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -89.61 132.48 9.74 Favored 'Cis proline' 0 C--N 1.349 0.595 0 C-N-CA 123.771 -1.345 . . . . 0.0 112.889 0.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.401 HD12 ' O ' ' A' ' 37' ' ' GLY . 29.2 mt -138.53 135.45 35.08 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.012 179.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -114.73 139.52 49.62 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.049 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.594 ' HB3' HD12 ' A' ' 53' ' ' LEU . 5.7 mt -80.81 108.89 14.86 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.945 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 5.8 m80 -114.0 120.42 40.58 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.116 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.592 ' CD2' HD21 ' A' ' 53' ' ' LEU . 0.5 OUTLIER -88.88 129.53 35.58 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.854 179.721 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 17.6 mtp -125.8 117.8 24.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.53 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 20.0 m-20 -79.18 -54.25 6.17 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.794 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -172.9 -61.34 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.353 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -107.46 -24.76 11.7 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.434 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.576 HD22 HD11 ' A' ' 51' ' ' ILE . 0.3 OUTLIER -110.59 149.84 29.82 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.865 0.364 . . . . 0.0 111.389 -179.681 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.53 122.36 45.46 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.001 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.576 HD11 HD22 ' A' ' 49' ' ' LEU . 28.7 mm -114.37 131.36 66.62 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.785 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.61 HD23 ' N ' ' A' ' 53' ' ' LEU . 4.7 tt -94.78 130.52 41.29 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.783 0.325 . . . . 0.0 111.024 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.61 ' N ' HD23 ' A' ' 52' ' ' LEU . 0.7 OUTLIER -81.79 95.32 7.25 Favored 'General case' 0 CA--C 1.527 0.086 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.379 179.37 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -84.71 -36.03 22.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.122 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.1 m-20 -144.67 -179.73 6.76 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.936 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.577 ' HA ' HD12 ' A' ' 59' ' ' LEU . 13.3 tp60 -58.41 -33.41 69.63 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.8 179.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -53.16 -41.65 65.38 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.201 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -64.53 -40.96 96.57 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.769 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.577 HD12 ' HA ' ' A' ' 56' ' ' GLN . 11.0 mt -65.52 -42.0 92.53 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.008 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.414 ' HA ' HD12 ' A' ' 63' ' ' ILE . 4.5 m-20 -60.93 -39.81 90.83 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.91 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -68.24 -39.48 82.27 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.642 178.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.442 ' HB1' ' CZ ' ' A' ' 44' ' ' TYR . . . -65.65 -43.67 88.68 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.558 179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.414 HD12 ' HA ' ' A' ' 60' ' ' ASP . 8.2 mt -62.81 -40.97 90.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 116.701 -0.227 . . . . 0.0 110.771 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -52.86 -34.97 56.8 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.24 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 30.6 mm -66.65 -45.37 88.54 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.158 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.07 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.0 mt -66.77 -45.14 79.46 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.988 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.12 -40.16 94.96 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.004 179.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -63.21 -35.23 79.63 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.129 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.8 t -70.48 122.14 19.1 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.899 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.74 -36.01 75.73 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.222 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 32.3 p -70.64 -81.06 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.907 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.3 tmm? 64.04 160.01 0.1 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.064 0.459 . . . . 0.0 111.696 179.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.34 -59.72 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.367 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 m -155.52 174.77 14.79 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.574 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.4 mp -91.95 131.66 37.1 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.413 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -95.7 74.78 3.18 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.136 0.493 . . . . 0.0 111.199 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.46 HG12 ' CE2' ' A' ' 44' ' ' TYR . 25.6 mt -103.92 129.22 56.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.819 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.9 tt -113.38 118.25 34.03 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.103 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.3 pp -104.19 131.55 51.37 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.706 179.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.4 pp -118.8 159.72 23.21 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.067 0.46 . . . . 0.0 111.334 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -90.72 147.6 23.15 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.77 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 -77.93 5.46 9.69 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -83.86 -167.05 1.58 Allowed 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.511 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 10.6 mtt85 -128.63 104.05 7.44 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.698 0.285 . . . . 0.0 111.215 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.4 p-10 -114.85 34.15 4.98 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.143 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -89.24 159.64 17.33 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.049 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -144.15 163.18 34.35 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.274 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 69.1 m80 -139.72 117.76 11.83 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.174 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 41.7 m80 -141.21 34.98 1.7 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.248 179.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -141.69 163.75 32.08 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.03 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 8.9 m80 -97.81 32.73 2.26 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.208 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -154.66 34.35 0.4 Allowed 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.012 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 1.4 t60 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.098 -0.953 . . . . 0.0 110.973 179.969 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 . . . . . 0 N--CA 1.491 1.579 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 m 63.03 72.44 0.49 Allowed 'General case' 0 CA--C 1.529 0.143 0 CA-C-O 121.128 0.489 . . . . 0.0 111.028 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -167.04 82.24 0.23 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.302 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.616 HG23 ' HG3' ' A' ' 21' ' ' ARG . 36.2 t -79.86 125.14 38.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.868 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.3 mtm105 -94.36 106.34 18.32 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.699 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.7 mp -101.92 134.43 42.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.997 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.8 mttm -100.34 118.09 35.89 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.714 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.492 ' CD1' HD12 ' A' ' 17' ' ' ILE . 93.2 m-85 -107.39 131.88 53.78 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.146 -179.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -126.58 131.94 51.41 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.212 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 9.0 t-160 -139.49 121.08 15.2 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.529 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.0 m-20 57.25 31.64 20.41 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.221 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.11 -30.22 7.87 Favored Glycine 0 CA--C 1.524 0.609 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.937 -179.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -65.61 140.57 58.53 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.761 0.315 . . . . 0.0 111.187 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -103.69 154.97 18.95 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.32 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.2 tpp180 -151.76 144.23 24.15 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.069 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.3 mt -113.66 127.64 70.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.001 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.492 HD12 ' CD1' ' A' ' 8' ' ' PHE . 20.1 mt -138.39 125.61 27.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-O 120.784 0.326 . . . . 0.0 111.29 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -112.49 131.07 55.77 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.042 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -128.07 126.8 41.93 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.75 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 18.3 t -68.3 128.11 35.38 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.946 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.616 ' HG3' HG23 ' A' ' 4' ' ' VAL . 8.6 mtm180 -71.35 150.83 94.21 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.062 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -74.62 125.76 11.62 Favored 'Cis proline' 0 C--N 1.35 0.645 0 C-N-CA 123.517 -1.451 . . . . 0.0 112.308 0.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.5 p -73.58 131.91 34.19 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.04 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.504 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -96.98 127.14 42.66 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.154 -179.762 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.484 ' OH ' HD22 ' A' ' 42' ' ' LEU . 71.3 t80 -53.95 -43.72 70.1 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.076 179.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.406 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 1.4 mm-40 -60.97 -38.85 87.38 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.087 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -69.17 -44.27 72.58 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.124 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 24' ' ' LYS . 22.0 t -63.76 -47.24 91.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.019 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.406 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 11.5 pt-20 -63.91 -36.75 84.96 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.186 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -56.68 -45.22 81.87 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.583 0.23 . . . . 0.0 111.061 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.574 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.3 OUTLIER -68.89 -48.84 62.36 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.325 179.819 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 50.0 t -62.63 -40.58 88.92 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.538 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.73 HG23 ' HB3' ' A' ' 38' ' ' GLN . 79.9 m -61.01 -47.26 87.27 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.896 -0.138 . . . . 0.0 111.269 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.0 m -72.88 -44.52 61.21 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' ' 31' ' ' LYS . 70.1 t -67.1 -44.8 87.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.235 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.575 ' HB2' HD11 ' A' ' 40' ' ' LEU . 15.9 m-85 -100.28 7.06 44.65 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.09 172.7 23.59 Favored Glycine 0 C--N 1.339 0.704 0 C-N-CA 120.503 -0.856 . . . . 0.0 112.88 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.73 ' HB3' HG23 ' A' ' 33' ' ' THR . 6.8 pt20 -135.04 154.65 79.23 Favored Pre-proline 0 C--O 1.234 0.242 0 O-C-N 122.853 -0.204 . . . . 0.0 110.98 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.43 ' HG2' ' HB3' ' A' ' 82' ' ' GLN . 95.7 Cg_endo -88.02 153.61 38.33 Favored 'Cis proline' 0 C--N 1.35 0.609 0 C-N-CA 123.567 -1.43 . . . . 0.0 113.338 0.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.575 HD11 ' HB2' ' A' ' 36' ' ' PHE . 15.7 mt -124.6 160.4 28.51 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.08 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -111.46 126.3 54.8 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.661 179.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.484 HD22 ' OH ' ' A' ' 25' ' ' TYR . 5.2 mp -90.23 96.24 10.57 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.818 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -115.22 122.98 47.66 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.284 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.537 ' HB2' HD21 ' A' ' 53' ' ' LEU . 11.7 t80 -105.79 129.4 53.99 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.691 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -131.27 120.73 23.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.731 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -85.02 -68.42 0.73 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.851 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -149.08 -74.61 0.17 Allowed 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.393 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -110.1 4.66 21.4 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.433 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.465 HD12 HD11 ' A' ' 51' ' ' ILE . 0.6 OUTLIER -130.12 140.03 50.84 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.792 0.329 . . . . 0.0 111.277 -179.917 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -115.23 128.3 56.06 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.712 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.465 HD11 HD12 ' A' ' 49' ' ' LEU . 18.8 mt -128.39 134.26 65.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.958 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 39.8 mt -93.85 132.81 37.9 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.941 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.537 HD21 ' HB2' ' A' ' 44' ' ' TYR . 0.8 OUTLIER -122.95 88.04 2.86 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.011 0.434 . . . . 0.0 111.26 179.719 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.92 -32.51 14.54 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.969 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.4 m-20 -100.87 166.64 10.74 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.982 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -31.98 73.44 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.027 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -56.82 -50.11 73.35 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.063 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -63.09 -45.02 94.1 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.822 0.344 . . . . 0.0 110.802 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.3 tp -58.59 -45.88 88.16 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.022 179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.63 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.4 OUTLIER -63.79 -42.18 97.79 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.012 179.892 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.8 tmtt? -62.34 -38.63 90.21 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.729 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.74 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -62.42 -39.88 94.75 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.54 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.63 HD12 ' HA ' ' A' ' 60' ' ' ASP . 12.7 mt -63.57 -43.73 98.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-O 120.606 0.241 . . . . 0.0 110.881 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -56.17 -39.5 72.43 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.11 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.74 HD12 ' HA ' ' A' ' 62' ' ' ALA . 12.4 mt -64.03 -45.03 97.83 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.907 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.638 HD13 HD12 ' A' ' 75' ' ' LEU . 5.5 tt -61.85 -47.35 85.45 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.673 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -58.6 -40.31 82.89 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.076 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -33.14 74.02 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.384 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 33.6 t -83.2 119.97 25.22 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.754 0.311 . . . . 0.0 111.208 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.4 p -68.0 -35.37 78.21 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.921 179.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.99 -37.08 67.13 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.402 -179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.45 ' SD ' HD12 ' A' ' 66' ' ' LEU . 0.0 OUTLIER -80.89 109.0 15.03 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-O 120.711 0.291 . . . . 0.0 111.132 -179.844 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.77 -31.99 7.24 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.784 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.2 m -122.15 154.35 37.54 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.656 0.265 . . . . 0.0 110.948 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.638 HD12 HD13 ' A' ' 66' ' ' LEU . 1.1 mp -92.74 117.35 29.91 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.174 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.74 86.1 3.99 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.384 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.9 mt -102.26 131.79 49.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.681 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 41.8 tp -102.12 117.25 34.38 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.755 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.7 pp -104.87 126.95 52.48 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.865 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.8 mp -119.2 122.74 42.67 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.849 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.526 ' HA ' HD23 ' A' ' 40' ' ' LEU . 0.3 OUTLIER -74.75 142.84 44.3 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.153 -179.89 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.43 ' HB3' ' HG2' ' A' ' 39' ' ' PRO . 0.3 OUTLIER -85.39 5.63 30.05 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.904 179.584 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -138.98 167.39 22.15 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.954 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 4.7 mtt-85 -106.53 -34.91 7.23 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.255 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -98.14 142.43 29.84 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.799 0.333 . . . . 0.0 110.941 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.3 mt -102.59 138.37 39.59 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.179 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -119.53 166.04 13.63 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.198 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 19.6 t60 63.72 87.09 0.11 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.447 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 5.2 m170 -133.22 115.34 14.88 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.046 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 8.4 m170 -101.63 -66.42 0.92 Allowed 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.783 179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -138.4 146.71 42.54 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.807 0.337 . . . . 0.0 111.05 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -139.78 169.21 18.14 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.387 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.554 -0.736 . . . . 0.0 111.135 179.821 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.428 0 CA-C-O 121.096 0.474 . . . . 0.0 111.162 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.4 m 57.82 72.54 0.51 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.191 179.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -158.5 155.92 29.32 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.403 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.445 HG12 HD21 ' A' ' 75' ' ' LEU . 17.6 t -150.09 128.26 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.993 179.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -97.09 116.27 29.0 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.637 0.256 . . . . 0.0 110.963 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.735 HG12 HD11 ' A' ' 75' ' ' LEU . 21.7 mt -107.52 118.16 54.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.183 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.492 ' CD ' ' HB3' ' A' ' 74' ' ' SER . 0.0 OUTLIER -95.03 109.59 21.61 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.71 179.786 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -104.28 142.25 34.86 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.154 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -134.47 124.24 25.28 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.886 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -142.28 121.21 12.8 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.699 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 62.1 t30 57.16 34.0 24.18 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.88 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 91.02 -32.23 5.25 Favored Glycine 0 C--N 1.337 0.622 0 C-N-CA 121.047 -0.596 . . . . 0.0 113.075 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.35 136.86 55.47 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.836 0.35 . . . . 0.0 111.247 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -114.19 142.6 46.04 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.946 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.8 mtm-85 -134.11 140.49 46.63 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.172 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.461 HD12 ' HE2' ' A' ' 7' ' ' LYS . 25.9 mm -114.1 117.44 55.52 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.003 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.1 mt -125.78 137.89 56.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.215 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -110.54 133.94 52.84 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.172 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -125.4 122.83 37.86 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.196 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.88 158.49 19.31 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.042 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.05 154.95 40.58 Favored Pre-proline 0 CA--C 1.531 0.245 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.955 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -76.7 126.6 13.55 Favored 'Cis proline' 0 C--N 1.351 0.71 0 C-N-CA 123.396 -1.502 . . . . 0.0 112.737 -0.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.5 p -90.07 146.82 5.72 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.335 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.652 ' O ' HG23 ' A' ' 28' ' ' VAL . 4.5 mtpt -120.82 143.66 48.75 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.098 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 24.3 t80 -54.79 -52.97 60.98 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.077 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.445 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 0.3 OUTLIER -61.1 -34.82 75.55 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.163 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.33 -43.54 77.29 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.139 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.668 ' O ' HG23 ' A' ' 32' ' ' VAL . 43.5 t -63.18 -47.63 91.44 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.126 0 CA-C-N 116.693 -0.231 . . . . 0.0 111.146 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.445 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 9.3 pt-20 -64.49 -37.9 89.13 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.276 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.79 -49.03 76.55 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.722 -0.217 . . . . 0.0 110.892 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.66 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.1 OUTLIER -67.74 -48.96 64.98 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.278 179.861 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.668 HG23 ' O ' ' A' ' 28' ' ' VAL . 43.0 t -59.17 -41.44 83.73 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 116.678 -0.237 . . . . 0.0 111.358 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 99.4 m -65.01 -41.45 95.32 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.908 -0.133 . . . . 0.0 111.042 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.9 m -72.76 -43.71 62.53 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 121.108 -0.237 . . . . 0.0 111.617 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' ' 31' ' ' LYS . 48.5 t -66.47 -49.67 73.41 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 N-CA-C 111.574 0.213 . . . . 0.0 111.574 -179.411 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -88.71 -10.72 47.41 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -179.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.5 ' O ' HD13 ' A' ' 40' ' ' LEU . . . 91.21 -176.89 40.8 Favored Glycine 0 C--N 1.338 0.65 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.575 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.416 ' HA ' HD12 ' A' ' 40' ' ' LEU . 1.0 OUTLIER -145.19 156.31 54.35 Favored Pre-proline 0 N--CA 1.465 0.285 0 CA-C-O 120.528 0.204 . . . . 0.0 110.83 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.527 ' C ' HD12 ' A' ' 40' ' ' LEU . 92.0 Cg_endo -93.25 128.22 5.12 Favored 'Cis proline' 0 C--N 1.351 0.699 0 C-N-CA 123.918 -1.284 . . . . 0.0 112.933 0.099 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.801 HD23 HD13 ' A' ' 79' ' ' LEU . 6.3 mp -134.57 139.98 45.78 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.992 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.66 139.47 38.2 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.137 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.576 HD21 HG11 ' A' ' 32' ' ' VAL . 0.8 OUTLIER -91.06 106.47 18.54 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.213 -179.8 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -101.65 118.98 38.05 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.251 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.418 ' OH ' ' HB1' ' A' ' 62' ' ' ALA . 2.2 t80 -88.95 118.5 28.72 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.822 179.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.684 ' HB2' HD21 ' A' ' 78' ' ' LEU . 0.9 OUTLIER -130.63 116.16 17.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.764 179.891 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -80.85 -50.35 9.9 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.791 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.45 -63.7 0.02 OUTLIER 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.61 179.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 8.6 mp0 -109.54 -24.12 11.15 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.726 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.7 mp -103.4 138.83 39.6 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.79 0.328 . . . . 0.0 111.317 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 87.2 p -114.32 121.62 44.19 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.87 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.5 mp -124.44 134.28 67.12 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.712 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 14.6 tp -98.96 124.91 44.23 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.771 -0.195 . . . . 0.0 110.705 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.486 HD22 HD23 ' A' ' 59' ' ' LEU . 1.5 mt -65.0 103.42 0.73 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.912 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.1 mtmm -103.1 -31.78 9.99 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.703 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -148.08 173.85 12.52 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.779 0.323 . . . . 0.0 111.465 -179.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.468 ' HA ' HD12 ' A' ' 59' ' ' LEU . 1.3 mt-30 -56.94 -29.72 63.4 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.138 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -53.08 -41.74 65.19 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.036 179.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -68.39 -40.67 81.28 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.761 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.486 HD23 HD22 ' A' ' 53' ' ' LEU . 36.5 mt -63.52 -40.28 96.62 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.526 179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.87 ' HA ' HD12 ' A' ' 63' ' ' ILE . 1.2 t0 -67.22 -37.62 83.9 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.163 179.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.47 -36.69 83.28 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.769 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.418 ' HB1' ' OH ' ' A' ' 44' ' ' TYR . . . -62.84 -37.71 87.86 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.185 179.344 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.87 HD12 ' HA ' ' A' ' 60' ' ' ASP . 11.1 mt -63.84 -44.29 98.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.951 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.03 -39.34 69.02 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.063 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 29.5 mt -66.79 -42.97 90.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.015 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 40.4 mt -67.45 -46.41 73.15 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.139 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -60.98 -38.94 87.76 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.369 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -65.69 -32.68 74.37 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.427 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 33.8 t -109.26 93.59 4.59 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.959 -179.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.8 m -59.48 -27.28 65.98 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.765 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 2.0 t -57.67 -35.39 70.5 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.542 0.21 . . . . 0.0 111.282 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -117.21 163.17 16.7 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.762 0.315 . . . . 0.0 111.251 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -162.24 36.56 0.12 Allowed 'General case' 0 C--O 1.235 0.342 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.265 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.492 ' HB3' ' CD ' ' A' ' 7' ' ' LYS . 0.9 OUTLIER -143.18 149.11 37.57 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.708 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.735 HD11 HG12 ' A' ' 6' ' ' ILE . 0.1 OUTLIER -111.58 132.92 54.2 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.855 179.78 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.81 119.45 36.43 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.956 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.436 HD11 HD12 ' A' ' 75' ' ' LEU . 16.0 mt -128.45 118.33 47.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.873 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.684 HD21 ' HB2' ' A' ' 45' ' ' MET . 0.4 OUTLIER -106.3 122.17 45.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.955 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.801 HD13 HD23 ' A' ' 40' ' ' LEU . 3.0 pp -114.36 135.85 53.63 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.691 179.689 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.485 ' N ' HD12 ' A' ' 80' ' ' LEU . 3.0 mp -114.3 144.35 43.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.792 -179.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -98.84 136.55 38.7 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.008 0.433 . . . . 0.0 110.999 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.51 6.05 39.66 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.123 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 8.4 p30 -61.97 87.86 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.005 0.431 . . . . 0.0 111.101 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? 59.01 35.38 24.01 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.3 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 68.37 170.7 0.28 Allowed 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.241 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -110.98 154.45 24.12 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.852 0.358 . . . . 0.0 111.414 -179.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.32 133.4 43.85 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.257 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -152.84 -55.11 0.12 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.136 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 67.75 -75.3 0.06 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.392 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -154.57 -57.96 0.11 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.546 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -139.51 164.3 30.25 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.183 179.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -162.0 -49.64 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.99 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.233 -0.889 . . . . 0.0 111.498 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 120.71 0.291 . . . . 0.0 111.406 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.4 t -108.03 78.82 1.21 Allowed 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.07 0.462 . . . . 0.0 111.031 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -114.88 172.34 7.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.18 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.2 t -131.34 129.0 62.11 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.966 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.443 ' NH1' HG22 ' A' ' 16' ' ' ILE . 5.8 mtt-85 -88.5 112.72 23.31 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.952 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.555 HD12 ' HD2' ' A' ' 19' ' ' PHE . 6.2 mt -106.33 128.65 60.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.956 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 23.5 mtpt -104.04 125.23 50.23 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.586 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.502 ' CE1' HD12 ' A' ' 17' ' ' ILE . 20.6 m-85 -109.21 144.54 37.18 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.213 -179.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -121.77 124.0 43.16 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.294 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.676 ' HB2' HD11 ' A' ' 79' ' ' LEU . 12.1 t-160 -141.2 115.83 9.6 Favored 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.438 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 56.8 m-20 58.21 30.9 20.1 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 120.818 0.342 . . . . 0.0 111.137 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.9 -2.79 87.7 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 121.105 -0.569 . . . . 0.0 113.296 -179.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -85.64 143.08 28.63 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 117.216 0.508 . . . . 0.0 110.886 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.01 137.74 43.41 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.12 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -133.94 133.78 41.8 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.788 179.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.443 HG22 ' NH1' ' A' ' 5' ' ' ARG . 3.4 mp -114.07 117.29 55.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.073 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.502 HD12 ' CE1' ' A' ' 8' ' ' PHE . 10.9 mt -129.38 131.36 67.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.157 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -102.81 145.41 29.8 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.136 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.555 ' HD2' HD12 ' A' ' 6' ' ' ILE . 46.2 m-85 -138.84 116.9 11.71 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.031 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.4 p -78.98 135.84 37.04 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.031 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.1 mtt180 -74.87 152.81 86.87 Favored Pre-proline 0 CA--C 1.531 0.243 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.844 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -72.79 129.04 16.46 Favored 'Cis proline' 0 C--N 1.35 0.611 0 C-N-CA 123.763 -1.349 . . . . 0.0 112.426 0.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.431 ' O ' HG13 ' A' ' 23' ' ' VAL . 15.0 p -99.94 118.8 47.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.163 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.495 ' O ' HG23 ' A' ' 28' ' ' VAL . 11.0 mmmt -91.32 132.44 36.17 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.979 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.52 ' CD2' HD22 ' A' ' 59' ' ' LEU . 38.6 t80 -54.44 -41.64 69.64 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.704 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -59.32 -45.32 91.64 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.051 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.69 -44.63 85.59 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.121 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.677 ' O ' HG23 ' A' ' 32' ' ' VAL . 38.9 t -62.91 -47.94 90.39 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.918 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -60.78 -41.61 95.91 Favored 'General case' 0 N--CA 1.461 0.1 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.936 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -57.23 -48.43 78.85 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.119 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.692 ' O ' HG23 ' A' ' 35' ' ' VAL . 4.9 tttt -68.62 -49.5 58.71 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.257 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.677 HG23 ' O ' ' A' ' 28' ' ' VAL . 45.6 t -58.4 -44.67 89.14 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 CA-C-N 116.814 -0.176 . . . . 0.0 111.295 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 91.1 m -66.79 -39.38 87.76 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.192 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.4 m -72.15 -43.24 64.94 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.692 HG23 ' O ' ' A' ' 31' ' ' LYS . 60.6 t -64.92 -51.41 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-O 120.463 0.173 . . . . 0.0 111.246 -179.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -83.67 -20.37 33.67 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -179.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.525 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 100.08 -179.77 29.95 Favored Glycine 0 C--N 1.338 0.656 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.521 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -139.55 156.36 71.39 Favored Pre-proline 0 N--CA 1.464 0.26 0 O-C-N 122.73 -0.276 . . . . 0.0 111.175 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.41 ' HG2' ' HB2' ' A' ' 82' ' ' GLN . 95.2 Cg_endo -85.75 137.04 21.62 Favored 'Cis proline' 0 C--N 1.35 0.621 0 C-N-CA 123.438 -1.484 . . . . 0.0 112.897 0.091 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.525 HD12 ' O ' ' A' ' 37' ' ' GLY . 47.4 mt -137.9 130.07 28.96 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.515 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -103.68 138.78 39.84 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.9 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.579 HD21 HG11 ' A' ' 32' ' ' VAL . 4.2 mt -95.62 110.4 22.51 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.786 179.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 15.2 t60 -111.09 126.71 55.12 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.954 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.469 ' HD2' HD22 ' A' ' 53' ' ' LEU . 0.5 OUTLIER -89.14 126.33 35.42 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.722 179.736 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -131.2 118.55 20.59 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.617 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -83.61 -58.99 2.58 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.675 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -175.31 -52.29 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.544 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -109.37 -30.6 7.89 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.542 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.9 mp -112.41 154.77 25.27 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-O 120.788 0.328 . . . . 0.0 111.222 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -121.27 126.78 50.4 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.91 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 28.3 mm -113.75 134.44 56.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.859 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -96.59 126.7 41.95 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.792 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.614 HD13 HD13 ' A' ' 59' ' ' LEU . 0.5 OUTLIER -99.37 87.33 3.59 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 121.045 0.45 . . . . 0.0 110.835 179.939 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.3 mtpp -105.03 -34.2 8.06 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.138 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -103.92 163.49 12.33 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 120.78 0.324 . . . . 0.0 110.973 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.1 tm0? -63.34 -37.95 89.25 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.799 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.55 -38.54 84.82 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.206 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.62 -49.92 75.57 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.04 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.614 HD13 HD13 ' A' ' 53' ' ' LEU . 13.0 tp -63.89 -40.94 97.68 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.93 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.561 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.4 OUTLIER -67.06 -37.62 84.35 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.213 179.726 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -62.66 -39.35 93.63 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.665 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.75 -38.27 90.47 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.088 179.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.619 ' HA ' HD12 ' A' ' 66' ' ' LEU . 25.2 mt -65.49 -41.9 92.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.141 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -54.45 -39.59 67.57 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.037 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 45.1 mt -64.7 -38.37 82.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.949 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.728 HD11 ' HG ' ' A' ' 75' ' ' LEU . 15.9 mt -64.17 -45.37 88.73 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.828 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.86 -32.63 69.62 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.302 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.1 mtt-85 -66.09 -31.81 72.9 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.119 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.5 t -104.02 112.07 24.9 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.241 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.71 -33.4 71.57 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.461 179.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.8 p -72.79 -71.08 0.31 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.432 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.74 106.32 6.24 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 120.842 0.353 . . . . 0.0 111.384 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 25.1 pttt -114.74 -35.84 4.71 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.483 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.87 170.3 11.4 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 120.714 0.292 . . . . 0.0 111.526 -179.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.728 ' HG ' HD11 ' A' ' 66' ' ' LEU . 6.2 mp -114.9 133.5 55.93 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.399 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -102.6 81.45 2.03 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.517 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.5 mt -106.42 129.64 59.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.016 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.2 pp -109.03 132.65 53.91 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.023 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.676 HD11 ' HB2' ' A' ' 10' ' ' HIS . 3.1 pp -111.15 135.9 50.99 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.634 179.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.6 mt -112.57 146.9 37.73 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.168 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.5 t -94.57 147.89 22.81 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.811 179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.41 ' HB2' ' HG2' ' A' ' 39' ' ' PRO . 1.7 mm-40 -80.07 5.28 14.63 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 112.378 0.511 . . . . 0.0 112.378 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 -125.6 70.84 1.2 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.909 0.385 . . . . 0.0 110.436 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.77 46.03 1.13 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.705 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -97.31 135.43 39.23 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.485 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 21.9 mt 66.63 172.72 0.25 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.049 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 58.88 90.0 0.05 Allowed 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.819 0.342 . . . . 0.0 111.381 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -121.76 109.73 15.07 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.213 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 71.8 t60 -127.14 -78.98 0.59 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.547 179.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 8.3 t60 43.77 77.23 0.07 Allowed 'General case' 0 C--O 1.234 0.288 0 C-N-CA 122.608 0.363 . . . . 0.0 111.617 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 65.24 -169.87 0.2 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.954 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -156.75 132.88 9.75 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.621 0.248 . . . . 0.0 111.402 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 67.7 m-70 . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.447 -0.787 . . . . 0.0 110.775 179.857 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 . . . . . 0 N--CA 1.489 1.494 0 CA-C-O 120.777 0.323 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.0 m -89.27 175.7 7.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.764 179.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 72.07 126.66 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.841 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.657 HG21 ' NH2' ' A' ' 21' ' ' ARG . 21.3 t -134.37 146.78 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.616 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -93.67 133.08 37.4 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.981 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.483 HD12 ' CD1' ' A' ' 19' ' ' PHE . 29.7 mt -114.76 136.4 51.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.918 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.7 mttt -108.25 122.39 46.84 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.753 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -116.66 139.89 50.02 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.873 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.649 ' HB2' HD12 ' A' ' 78' ' ' LEU . 0.3 OUTLIER -119.34 131.37 55.71 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.1 -179.826 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.6 t-160 -136.01 114.7 11.96 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.658 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 57.72 35.14 25.28 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.218 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 95.23 -35.22 4.38 Favored Glycine 0 C--N 1.337 0.635 0 C-N-CA 120.915 -0.66 . . . . 0.0 113.005 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.39 150.47 48.24 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.611 0.243 . . . . 0.0 111.135 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -118.37 141.01 48.97 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.221 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 91.9 mtt-85 -129.14 147.77 51.02 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.1 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 19.2 mt -115.03 126.45 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.087 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 9.2 tp -140.22 135.31 36.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.278 179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -101.85 141.19 35.08 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.14 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.483 ' CD1' HD12 ' A' ' 6' ' ' ILE . 9.5 m-85 -126.52 153.05 45.69 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.119 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 47.5 t -95.31 142.84 27.24 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.19 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.657 ' NH2' HG21 ' A' ' 4' ' ' VAL . 0.2 OUTLIER -97.12 140.85 22.31 Favored Pre-proline 0 CA--C 1.53 0.208 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.633 179.627 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.409 ' HA ' ' CG ' ' A' ' 21' ' ' ARG . 4.0 Cg_exo -74.6 143.89 79.24 Favored 'Cis proline' 0 C--N 1.351 0.695 0 C-N-CA 123.78 -1.342 . . . . 0.0 112.676 0.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.0 p -105.99 133.79 49.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.908 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.522 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -97.9 142.71 29.3 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.924 -179.664 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -60.34 -43.7 96.2 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.979 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -60.05 -41.88 93.29 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.951 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.95 -44.48 92.68 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.328 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.695 ' O ' HG23 ' A' ' 32' ' ' VAL . 33.4 t -67.28 -47.47 81.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.78 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -57.87 -45.78 85.82 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.161 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -56.87 -47.3 80.75 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.102 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.716 ' O ' HG23 ' A' ' 35' ' ' VAL . 25.9 tttt -67.09 -49.57 64.54 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.17 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.695 HG23 ' O ' ' A' ' 28' ' ' VAL . 47.9 t -58.26 -44.76 88.76 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.344 -179.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 87.7 m -61.2 -40.42 93.88 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.151 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 20.5 m -72.54 -42.93 64.19 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 111.525 0.194 . . . . 0.0 111.525 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.716 HG23 ' O ' ' A' ' 31' ' ' LYS . 62.1 t -62.54 -52.23 62.44 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -87.09 -18.77 29.73 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -179.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 98.11 179.66 32.78 Favored Glycine 0 C--N 1.337 0.622 0 C-N-CA 120.65 -0.785 . . . . 0.0 112.612 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.3 pm0 -140.36 154.14 69.38 Favored Pre-proline 0 N--CA 1.465 0.315 0 O-C-N 122.863 -0.198 . . . . 0.0 110.927 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -83.3 143.87 48.6 Favored 'Cis proline' 0 C--N 1.35 0.618 0 C-N-CA 123.525 -1.448 . . . . 0.0 113.033 0.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.744 HD13 HD13 ' A' ' 79' ' ' LEU . 17.8 mt -138.52 138.93 38.5 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.155 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -104.83 119.44 39.01 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.987 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.84 113.63 22.14 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.943 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -114.08 119.52 37.41 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.135 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -101.85 129.76 48.15 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.694 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.66 133.33 55.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.785 179.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -83.32 -59.65 2.39 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.521 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -149.97 -65.11 0.21 Allowed 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.408 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.481 ' O ' HD22 ' A' ' 49' ' ' LEU . 3.2 mp0 -123.21 10.74 9.35 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.54 179.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.481 HD22 ' O ' ' A' ' 48' ' ' GLU . 3.9 mm? -126.75 164.77 20.6 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.625 0.25 . . . . 0.0 111.114 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -121.06 118.43 29.77 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.888 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 22.3 mt -120.17 133.06 68.12 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.991 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.31 122.75 45.45 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.86 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.52 91.82 6.97 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.722 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.8 -32.17 16.2 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.397 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -116.1 162.33 17.58 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.758 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -62.31 -31.36 71.97 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.991 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -53.45 -46.0 69.72 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.771 0.319 . . . . 0.0 110.815 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.38 -37.36 87.22 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.299 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.65 HD13 ' C ' ' A' ' 59' ' ' LEU . 1.2 tm? -61.24 -47.14 87.41 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.482 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.425 ' N ' HD13 ' A' ' 59' ' ' LEU . 31.4 t70 -68.39 -32.15 72.02 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.151 179.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.0 tttm -62.64 -38.44 90.28 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.765 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.602 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -65.76 -36.11 82.62 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.069 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 36.4 mm -59.36 -47.78 89.38 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.836 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -55.49 -42.61 74.65 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.917 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.602 HD12 ' HA ' ' A' ' 62' ' ' ALA . 9.9 mt -67.73 -43.09 86.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.141 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.959 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 13.9 tp -58.74 -45.57 89.37 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.83 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -65.83 -32.65 74.29 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.18 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.6 mmt180 -64.69 -33.51 76.13 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.563 -0.289 . . . . 0.0 111.32 179.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 42.2 t -103.36 111.25 23.58 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.184 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 51.6 p -62.49 -39.97 95.19 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.968 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 32.8 p -61.14 -34.65 75.34 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.435 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.5 ttp -90.89 92.52 8.81 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.715 0.293 . . . . 0.0 110.99 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -97.86 -34.63 10.78 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.169 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 41.2 m -92.2 166.71 12.49 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.838 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.8 mt -97.53 120.72 38.42 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.964 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.0 mtp180 -89.66 84.51 6.32 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.684 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 15.2 mt -117.72 124.14 72.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.126 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.649 HD12 ' HB2' ' A' ' 9' ' ' GLU . 1.3 tp -111.38 117.37 32.91 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.813 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.744 HD13 HD13 ' A' ' 40' ' ' LEU . 3.3 pp -103.3 136.18 43.56 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.847 0.356 . . . . 0.0 111.158 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.7 mp -119.26 158.13 26.66 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.156 -179.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.635 ' HA ' HD23 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -88.91 137.1 32.62 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.076 179.839 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 48.4 tp60 -88.09 4.62 44.66 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.806 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -139.5 25.84 2.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.913 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 5.4 mtm180 -167.16 82.83 0.22 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.011 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -140.67 133.79 29.45 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.136 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.6 mt -174.72 -38.35 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.292 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -54.98 158.37 2.83 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 120.944 0.402 . . . . 0.0 111.957 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -78.16 172.99 12.73 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.472 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 40.3 t60 -108.66 -53.15 2.67 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.203 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 65.48 100.12 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.631 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . 0.401 ' O ' ' HB2' ' A' ' 92' ' ' HIS . 0.2 OUTLIER -107.57 168.28 9.36 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.976 179.945 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . 0.401 ' HB2' ' O ' ' A' ' 91' ' ' HIS . 13.0 m170 68.41 -76.28 0.06 Allowed 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 122.913 0.485 . . . . 0.0 111.198 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 39.1 t60 . . . . . 0 C--O 1.251 1.155 0 CA-C-O 118.341 -0.838 . . . . 0.0 110.8 179.705 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 120.627 0.251 . . . . 0.0 111.345 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.425 ' O ' ' HB2' ' A' ' 3' ' ' ASP . 61.7 p -170.54 161.84 7.89 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.815 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.425 ' HB2' ' O ' ' A' ' 2' ' ' SER . 1.1 m-20 69.53 146.7 0.06 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.407 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.7 t -140.16 127.38 23.62 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.003 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.1 120.08 28.0 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.917 0.389 . . . . 0.0 111.172 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.831 HG23 HD12 ' A' ' 77' ' ' ILE . 30.2 mm -106.27 117.7 52.52 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.055 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.0 mttt -101.87 111.56 23.86 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.541 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.467 ' CE2' ' HB3' ' A' ' 15' ' ' ARG . 1.8 p90 -117.0 142.58 46.77 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.179 -179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -122.39 140.07 53.12 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.444 -179.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.2 t-160 -140.94 113.39 8.07 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.439 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.2 m120 59.76 31.42 20.81 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.541 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 104.18 -43.95 1.57 Allowed Glycine 0 C--N 1.335 0.505 0 C-N-CA 120.847 -0.692 . . . . 0.0 113.223 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -70.96 135.85 48.14 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.762 0.281 . . . . 0.0 111.119 -179.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -119.24 156.73 29.39 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.787 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.467 ' HB3' ' CE2' ' A' ' 8' ' ' PHE . 1.1 tpt180 -141.39 143.74 34.11 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.285 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.412 ' O ' HD13 ' A' ' 17' ' ' ILE . 2.4 mt -116.9 118.93 60.44 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.054 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.412 HD13 ' O ' ' A' ' 16' ' ' ILE . 27.4 mm -129.95 137.58 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-O 120.746 0.308 . . . . 0.0 111.262 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.09 145.95 24.62 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.228 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.479 ' CZ ' HG13 ' A' ' 28' ' ' VAL . 33.8 m-85 -133.37 117.88 17.79 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.166 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 65.7 m -72.95 136.13 45.13 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.243 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 44.1 mtm180 -100.45 156.83 34.77 Favored Pre-proline 0 CA--C 1.53 0.182 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.006 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.18 122.28 8.11 Favored 'Cis proline' 0 C--N 1.35 0.654 0 C-N-CA 123.258 -1.559 . . . . 0.0 112.657 0.059 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.7 p -104.36 153.23 6.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.168 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -104.81 137.02 43.23 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.685 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -54.88 -37.06 65.81 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.67 179.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -58.52 -45.1 89.52 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.002 179.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -67.33 -44.66 78.55 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.161 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.479 HG13 ' CZ ' ' A' ' 19' ' ' PHE . 30.0 t -62.34 -47.32 93.59 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.127 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.85 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.27 -44.25 95.48 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.906 179.583 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -56.8 -40.92 76.83 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.098 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.791 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.3 OUTLIER -67.64 -49.47 62.77 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.167 179.772 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 28' ' ' VAL . 25.5 t -64.79 -41.29 91.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.373 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 96.5 m -60.17 -39.52 86.71 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.158 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 16.5 m -71.89 -29.09 63.97 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 121.238 -0.185 . . . . 0.0 111.344 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 31' ' ' LYS . 44.8 t -69.37 -53.67 23.87 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-O 120.583 0.23 . . . . 0.0 111.449 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -94.18 -11.22 30.83 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -178.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.602 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 101.92 177.39 28.04 Favored Glycine 0 C--N 1.335 0.504 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.646 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -129.46 153.89 80.68 Favored Pre-proline 0 C--O 1.233 0.227 0 CA-C-O 120.623 0.249 . . . . 0.0 111.18 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.429 ' CG ' ' HB2' ' A' ' 84' ' ' ARG . 95.5 Cg_endo -89.12 136.1 12.6 Favored 'Cis proline' 0 C--N 1.349 0.582 0 C-N-CA 123.494 -1.461 . . . . 0.0 112.919 0.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.712 HD23 ' HA ' ' A' ' 81' ' ' SER . 55.3 mt -138.03 136.14 36.58 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.722 179.601 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -115.19 140.55 48.99 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.051 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 mp -81.74 112.31 18.79 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.508 179.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.6 m-70 -101.36 129.86 47.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.899 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.855 ' HB2' HD21 ' A' ' 53' ' ' LEU . 0.9 OUTLIER -88.88 124.42 34.19 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-O 120.742 0.306 . . . . 0.0 111.32 -179.878 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 4.6 tpp -126.23 107.74 10.64 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.771 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 30.2 m-20 -78.91 -60.81 2.23 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.863 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -154.92 -59.07 0.11 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.573 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.43 11.78 6.38 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.553 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -131.59 152.49 50.75 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.648 0.261 . . . . 0.0 111.428 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 t -120.18 126.64 51.16 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.924 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.424 ' HB ' ' HB3' ' A' ' 44' ' ' TYR . 3.4 mt -114.1 134.33 57.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.855 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -93.84 126.78 39.23 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.85 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.855 HD21 ' HB2' ' A' ' 44' ' ' TYR . 1.3 mm? -100.54 96.77 7.6 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.033 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.4 tttm -93.98 -32.92 13.64 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.277 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.0 m-20 -136.99 173.2 11.95 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.754 0.311 . . . . 0.0 111.14 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -60.25 -29.81 69.02 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.958 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -53.65 -43.94 69.18 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.093 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -66.88 -38.37 86.17 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.645 179.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.44 -45.32 91.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.162 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.72 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.5 OUTLIER -62.14 -41.32 98.16 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.194 -179.837 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -62.32 -38.82 90.89 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.65 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.406 ' HB1' ' CZ ' ' A' ' 44' ' ' TYR . . . -63.6 -41.32 98.34 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.584 179.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.72 HD12 ' HA ' ' A' ' 60' ' ' ASP . 8.2 mt -63.55 -44.63 98.73 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 CA-C-O 120.66 0.267 . . . . 0.0 110.762 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.39 -42.3 77.7 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.174 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.1 mt -68.02 -42.41 85.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.087 179.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 10.0 tp -59.62 -46.21 89.67 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.976 179.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.37 -35.62 70.21 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.24 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.62 -31.74 63.7 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.098 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.7 t -64.76 141.42 58.78 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.439 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.5 t -70.3 -30.73 67.8 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.772 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 47.7 p -92.7 37.11 1.01 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.881 0.372 . . . . 0.0 111.484 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -72.0 140.76 49.24 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.977 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -179.04 -43.3 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.073 179.677 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 64.1 m -147.14 178.06 8.68 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.798 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.451 HD13 HD13 ' A' ' 6' ' ' ILE . 6.7 mp -106.72 119.36 39.12 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.89 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.0 ttp180 -82.56 77.94 9.26 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.995 0.426 . . . . 0.0 110.608 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.831 HD12 HG23 ' A' ' 6' ' ' ILE . 22.1 mt -104.4 118.58 51.89 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.883 -179.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.648 HD23 HD11 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -102.2 127.42 49.14 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.048 -179.879 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.559 ' O ' HD12 ' A' ' 79' ' ' LEU . 3.3 pp -111.15 131.13 55.35 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.046 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.648 HD11 HD23 ' A' ' 78' ' ' LEU . 1.7 mp -140.87 151.15 44.08 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.873 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.712 ' HA ' HD23 ' A' ' 40' ' ' LEU . 0.4 OUTLIER -67.79 132.7 47.9 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.993 179.92 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.82 5.34 46.57 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.288 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 60.76 100.52 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.777 179.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.429 ' HB2' ' CG ' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -144.15 50.59 1.32 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.09 179.963 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 61.62 -177.0 0.12 Allowed 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.472 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.1 mp -107.46 60.73 0.62 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.697 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.426 ' O ' ' HB2' ' A' ' 88' ' ' HIS . 0.2 OUTLIER 58.47 -166.85 0.15 Allowed 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.859 -179.694 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.426 ' HB2' ' O ' ' A' ' 87' ' ' GLU . 33.8 m170 70.6 136.61 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.863 0.363 . . . . 0.0 110.945 -179.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 21.2 m-70 -63.26 103.01 0.45 Allowed 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.486 -179.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.35 33.29 0.72 Allowed 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.078 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -174.52 178.48 1.95 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.005 -179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -146.19 54.1 1.14 Allowed 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 121.018 0.437 . . . . 0.0 110.883 179.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.226 -0.893 . . . . 0.0 110.767 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 120.813 0.339 . . . . 0.0 111.314 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 87.2 p -113.14 179.45 3.96 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.705 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.6 t70 63.88 94.55 0.05 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.98 0.419 . . . . 0.0 111.053 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.4 t -81.0 125.02 39.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.016 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.11 115.47 29.09 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.604 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.468 ' N ' HD12 ' A' ' 6' ' ' ILE . 3.8 mp -110.1 134.05 53.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.059 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.64 114.95 29.08 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.679 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.604 ' HB3' HD21 ' A' ' 79' ' ' LEU . 61.2 m-85 -103.2 127.03 50.64 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.775 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -120.33 124.05 44.61 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.916 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.8 t-160 -139.27 116.23 10.94 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.547 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.27 31.7 21.38 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.174 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.66 -28.79 9.42 Favored Glycine 0 C--N 1.339 0.695 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.867 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -65.03 137.4 57.68 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.796 0.331 . . . . 0.0 111.098 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -110.23 136.05 50.04 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.014 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.1 mtp180 -130.03 136.49 49.45 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.96 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.5 mp -114.38 117.4 55.46 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.873 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.407 HD12 ' CD2' ' A' ' 8' ' ' PHE . 19.9 mt -131.87 137.06 55.78 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 CA-C-O 120.828 0.347 . . . . 0.0 111.27 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -101.67 132.54 47.31 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.079 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.456 ' HD2' HD13 ' A' ' 6' ' ' ILE . 24.3 m-85 -124.96 126.48 45.54 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.977 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.1 m -72.78 153.89 40.9 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.375 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.5 mtt180 -95.48 146.98 32.27 Favored Pre-proline 0 CA--C 1.53 0.208 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.166 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -78.24 124.08 10.25 Favored 'Cis proline' 0 C--N 1.349 0.569 0 C-N-CA 123.313 -1.536 . . . . 0.0 112.49 -0.052 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.0 p -69.34 126.88 30.3 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.99 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.567 ' O ' HG23 ' A' ' 28' ' ' VAL . 23.1 mmmt -102.18 147.69 26.33 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.029 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.527 ' CZ ' HD12 ' A' ' 42' ' ' LEU . 33.4 t80 -60.42 -40.18 90.09 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.65 179.446 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -62.23 -44.71 95.94 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.246 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.85 -44.35 96.37 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.189 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.568 ' O ' HG23 ' A' ' 32' ' ' VAL . 35.9 t -65.86 -46.92 87.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.145 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.479 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -63.11 -42.15 99.5 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.266 179.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -56.2 -43.07 78.15 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.56 0.219 . . . . 0.0 111.471 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.687 ' O ' HG23 ' A' ' 35' ' ' VAL . 4.1 mttp -70.38 -49.7 46.36 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.183 179.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 28' ' ' VAL . 38.6 t -62.4 -40.98 90.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.463 -179.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.791 HG23 ' HB3' ' A' ' 38' ' ' GLN . 52.4 m -61.8 -43.02 99.68 Favored 'General case' 0 C--O 1.226 -0.182 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.194 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 40.1 m -72.44 -44.18 62.76 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 111.533 0.197 . . . . 0.0 111.533 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.687 HG23 ' O ' ' A' ' 31' ' ' LYS . 65.2 t -63.53 -48.43 86.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.229 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.44 ' HB2' ' CD1' ' A' ' 40' ' ' LEU . 68.7 m-85 -102.37 10.12 39.3 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -178.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.26 173.41 16.03 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 120.605 -0.807 . . . . 0.0 112.775 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.791 ' HB3' HG23 ' A' ' 33' ' ' THR . 0.0 OUTLIER -127.86 157.96 71.99 Favored Pre-proline 0 N--CA 1.464 0.229 0 O-C-N 122.814 -0.227 . . . . 0.0 110.763 179.93 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -89.34 153.3 30.54 Favored 'Cis proline' 0 C--N 1.35 0.611 0 C-N-CA 123.803 -1.332 . . . . 0.0 113.351 0.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.524 HD23 ' HA ' ' A' ' 81' ' ' SER . 51.9 mt -138.32 159.17 42.74 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.134 179.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -114.16 134.88 54.6 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.706 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.527 HD12 ' CZ ' ' A' ' 25' ' ' TYR . 50.7 mt -92.59 107.15 19.0 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.739 0.304 . . . . 0.0 110.834 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -113.78 129.58 56.56 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.279 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.562 ' HB2' HD11 ' A' ' 53' ' ' LEU . 14.8 t80 -108.27 124.3 50.11 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.477 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.0 ptm -126.18 130.83 51.77 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.855 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -89.92 -71.45 0.61 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.165 -179.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -142.13 -71.89 0.33 Allowed 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.553 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -117.53 16.73 14.61 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.128 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.1 mt -131.59 143.74 50.56 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.611 0.244 . . . . 0.0 110.924 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.67 126.61 54.69 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.93 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.403 HD13 ' CD1' ' A' ' 44' ' ' TYR . 3.8 mp -122.75 132.73 70.73 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.109 -179.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.1 tt -102.69 135.66 43.93 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.798 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.562 HD11 ' HB2' ' A' ' 44' ' ' TYR . 0.6 OUTLIER -109.13 110.22 21.41 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.914 -179.938 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.56 -36.14 9.28 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.23 179.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -129.72 174.06 10.05 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.07 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -56.61 -33.86 66.67 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.028 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -54.44 -46.06 73.17 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 123.277 0.36 . . . . 0.0 110.956 179.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -61.92 -43.9 97.88 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.804 179.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 22.9 tp -69.01 -37.95 78.98 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.377 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.541 ' HA ' HD12 ' A' ' 63' ' ' ILE . 1.2 t70 -61.74 -43.09 99.53 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.935 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.58 -33.72 75.59 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.971 179.466 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.552 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -62.55 -35.63 80.08 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.402 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.541 HD12 ' HA ' ' A' ' 60' ' ' ASP . 13.4 mt -65.93 -44.91 92.33 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 CA-C-O 120.642 0.258 . . . . 0.0 110.468 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -41.63 89.14 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.948 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.552 HD12 ' HA ' ' A' ' 62' ' ' ALA . 11.0 mt -67.6 -41.68 85.92 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.111 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.423 HD13 ' HG ' ' A' ' 75' ' ' LEU . 1.9 tp -59.98 -47.32 86.29 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.85 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -67.63 -36.74 81.36 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.79 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 -66.21 -27.54 68.06 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.577 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 32.6 t -58.77 147.43 33.36 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.93 0.395 . . . . 0.0 111.629 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.6 p -71.33 -31.1 66.99 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.35 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.4 t -144.28 85.85 1.81 Allowed 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.955 0.407 . . . . 0.0 110.862 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 6.6 ttt -171.07 100.87 0.21 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.09 179.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.13 -35.1 10.12 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.234 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.405 ' C ' HD21 ' A' ' 66' ' ' LEU . 0.4 OUTLIER -98.54 159.02 15.23 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.61 0.243 . . . . 0.0 110.771 179.735 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.423 ' HG ' HD13 ' A' ' 66' ' ' LEU . 0.1 OUTLIER -91.93 126.41 37.0 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.816 -179.979 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -86.48 86.43 7.34 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.772 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.412 HD11 ' CD2' ' A' ' 75' ' ' LEU . 30.5 mm -104.15 128.22 57.75 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.052 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -114.58 118.74 34.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.688 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.604 HD21 ' HB3' ' A' ' 8' ' ' PHE . 0.2 OUTLIER -108.18 131.9 54.18 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.456 179.773 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.1 pp -125.59 151.1 46.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.09 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.524 ' HA ' HD23 ' A' ' 40' ' ' LEU . 1.1 p -65.57 146.92 54.24 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.067 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -82.77 5.53 21.16 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -91.29 50.57 1.77 Allowed 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.004 0.431 . . . . 0.0 111.151 179.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.2 ttt85 -112.44 58.13 0.65 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.017 179.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -73.47 102.7 3.87 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.874 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.44 -49.13 2.38 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.99 -179.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -90.05 136.3 33.13 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.107 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -113.32 110.51 20.47 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.714 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 19.5 m170 -104.48 141.29 36.63 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.223 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -162.28 88.88 0.67 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.92 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -102.74 33.88 3.04 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.956 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 64.5 t-80 -152.95 96.12 2.05 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.473 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 1.2 t60 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.113 -0.946 . . . . 0.0 111.068 -179.756 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 120.555 0.217 . . . . 0.0 111.305 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.6 m 68.56 174.33 0.28 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.966 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 66.08 105.01 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.999 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.4 t -111.03 100.19 10.25 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.988 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.6 mtt180 -89.34 108.63 19.74 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.799 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.523 HG21 HD12 ' A' ' 77' ' ' ILE . 7.0 mt -106.46 134.59 47.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.216 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 7.9 mmtt -103.1 121.29 42.31 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.735 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -109.41 138.45 45.75 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.974 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.406 ' HG3' ' HG2' ' A' ' 14' ' ' ARG . 1.3 tt0 -119.28 126.0 50.43 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.18 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -138.04 121.0 16.59 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.608 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 59.09 31.63 21.47 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.26 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.2 -35.78 3.98 Favored Glycine 0 C--N 1.337 0.638 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.775 -179.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -66.99 146.35 54.47 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.871 0.367 . . . . 0.0 111.219 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.406 ' HG2' ' HG3' ' A' ' 9' ' ' GLU . 22.6 mtm105 -113.51 147.18 38.39 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.361 -179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.94 136.28 40.3 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.087 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.6 mp -116.74 118.26 58.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.906 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.6 mt -127.98 136.49 60.13 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-O 120.863 0.363 . . . . 0.0 111.313 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.6 143.83 26.36 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.249 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.584 ' CE2' HG22 ' A' ' 28' ' ' VAL . 16.3 m-85 -130.79 133.66 46.17 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.08 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.88 132.58 35.22 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.986 179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.5 mtt180 -80.74 155.44 73.3 Favored Pre-proline 0 N--CA 1.464 0.226 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.087 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -72.75 124.68 9.44 Favored 'Cis proline' 0 C--N 1.349 0.579 0 C-N-CA 123.67 -1.388 . . . . 0.0 112.379 0.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.1 p -72.7 141.79 15.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.226 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.53 ' O ' HG23 ' A' ' 28' ' ' VAL . 11.0 mmtt -118.59 128.44 54.56 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.9 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -57.41 -36.59 71.52 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.78 179.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.26 -44.77 94.2 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.089 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -69.05 -44.36 72.8 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.124 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.705 ' O ' HG23 ' A' ' 32' ' ' VAL . 38.6 t -66.43 -47.47 83.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.151 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -61.47 -45.64 93.42 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.125 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.4 m170 -62.66 -45.2 93.91 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.723 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.751 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.4 OUTLIER -63.36 -49.34 74.26 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.408 179.921 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.705 HG23 ' O ' ' A' ' 28' ' ' VAL . 56.0 t -60.94 -42.65 93.65 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.377 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 92.1 m -61.98 -39.46 92.26 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.056 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.8 m -72.28 -41.4 66.73 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 111.6 0.222 . . . . 0.0 111.6 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.751 HG23 ' O ' ' A' ' 31' ' ' LYS . 50.7 t -60.0 -52.49 60.57 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-O 120.575 0.226 . . . . 0.0 111.545 -179.402 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -88.42 -23.24 23.37 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -179.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.499 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 104.25 -176.08 23.26 Favored Glycine 0 CA--C 1.523 0.588 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.371 -179.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -137.35 156.79 75.02 Favored Pre-proline 0 N--CA 1.466 0.349 0 CA-C-O 120.624 0.249 . . . . 0.0 111.134 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -85.85 140.17 26.64 Favored 'Cis proline' 0 C--N 1.349 0.574 0 C-N-CA 123.451 -1.479 . . . . 0.0 112.979 0.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.499 HD12 ' O ' ' A' ' 37' ' ' GLY . 21.8 mt -137.73 139.14 39.97 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.947 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -106.65 136.88 45.69 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.163 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 66.7 mt -86.54 108.74 18.7 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.048 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -112.23 119.96 40.13 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.899 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.402 ' HB3' ' CD2' ' A' ' 53' ' ' LEU . 10.3 t80 -106.33 130.06 54.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.562 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.1 ppp? -130.6 122.81 28.15 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.953 0.406 . . . . 0.0 110.937 179.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -79.12 -41.43 28.6 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.529 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -170.24 -67.18 0.02 OUTLIER 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.553 179.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -111.44 -24.64 10.05 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.634 179.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.457 HD13 ' N ' ' A' ' 50' ' ' SER . 0.2 OUTLIER -105.74 138.77 41.38 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.656 0.265 . . . . 0.0 111.328 -179.563 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.457 ' N ' HD13 ' A' ' 49' ' ' LEU . 17.0 t -110.09 131.06 55.39 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.711 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.3 mt -113.56 134.16 57.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.161 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.604 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.0 mt -84.47 118.04 24.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.034 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.562 HD13 ' CB ' ' A' ' 58' ' ' ASP . 3.4 mm? -86.33 100.0 11.99 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.312 179.513 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.6 mttt -135.22 25.22 3.53 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.932 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -173.5 157.18 3.17 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.653 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -61.09 -32.33 72.0 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.654 179.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.75 -45.82 81.77 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.888 179.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.562 ' CB ' HD13 ' A' ' 53' ' ' LEU . 8.1 m-20 -60.47 -42.29 95.95 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.814 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 13.6 tp -66.71 -42.6 86.12 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.804 179.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.896 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.2 OUTLIER -62.73 -38.88 92.23 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.379 179.977 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -39.93 95.67 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.804 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.99 -36.33 83.18 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.096 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.896 HD12 ' HA ' ' A' ' 60' ' ' ASP . 14.4 mt -65.18 -44.22 95.38 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.139 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.826 179.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -55.44 -45.78 76.77 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.082 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 10.7 mt -67.19 -40.44 85.15 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.607 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.491 HD21 ' O ' ' A' ' 73' ' ' LYS . 0.5 OUTLIER -64.0 -44.1 93.68 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.002 179.598 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -57.2 -34.58 68.65 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.183 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.2 mtp85 -73.66 -31.36 63.44 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.474 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.8 t -96.36 101.03 12.6 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.367 -179.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.7 t -59.74 -38.44 81.74 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.18 179.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 56.3 p -59.12 -36.12 74.63 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.236 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.34 149.36 30.3 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.065 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.491 ' O ' HD21 ' A' ' 66' ' ' LEU . 22.3 mttp -144.0 -47.23 0.27 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.148 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 95.4 p -101.89 167.65 9.93 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.95 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.1 mt -104.91 130.7 53.02 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.049 -179.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.33 81.26 8.43 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.938 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.523 HD12 HG21 ' A' ' 6' ' ' ILE . 24.3 mt -102.69 116.78 47.02 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.685 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 46.3 mt -101.95 117.34 34.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.614 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.419 HD13 HD13 ' A' ' 40' ' ' LEU . 1.8 pp -101.92 131.85 48.06 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.902 179.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.2 mp -129.35 155.12 46.14 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.027 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.468 ' HA ' HD23 ' A' ' 40' ' ' LEU . 0.4 OUTLIER -65.75 146.31 54.93 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.913 179.864 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.65 5.39 21.27 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.266 -0.425 . . . . 0.0 112.093 179.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -108.33 88.22 2.68 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.843 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 26.6 mtm-85 -100.57 35.46 2.14 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.316 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -133.21 56.4 1.85 Allowed 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.895 0.379 . . . . 0.0 111.26 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.1 tp -152.12 31.01 0.55 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.33 179.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -168.38 39.27 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 120.79 0.329 . . . . 0.0 111.48 179.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -80.28 125.45 29.89 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.847 0.356 . . . . 0.0 111.496 -179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 33.2 p80 -107.02 134.75 49.7 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.971 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 28.1 m80 61.36 177.65 0.11 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.49 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 33.4 m80 -144.85 -50.66 0.27 Allowed 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.189 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -134.68 28.3 3.61 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.742 0.306 . . . . 0.0 111.327 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 3.3 t60 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 117.796 -1.097 . . . . 0.0 111.018 -179.879 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 120.47 0.176 . . . . 0.0 111.125 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 m 68.69 164.4 0.24 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.072 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 57.34 93.26 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.308 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.2 t -108.56 128.59 64.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.447 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.6 mtt180 -89.88 113.23 24.8 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.796 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.506 ' CG2' HD12 ' A' ' 77' ' ' ILE . 3.0 mt -103.34 133.83 46.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.145 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -94.13 128.54 40.6 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.757 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.508 ' HB3' HD21 ' A' ' 79' ' ' LEU . 96.8 m-85 -116.96 132.23 56.75 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.909 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.404 ' HA ' ' O ' ' A' ' 13' ' ' GLU . 1.8 mt-10 -119.09 123.46 44.5 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.04 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 -129.35 118.0 21.53 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.734 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 57.92 33.68 23.47 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.472 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.67 -29.08 9.57 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.989 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.404 ' O ' ' HA ' ' A' ' 9' ' ' GLU . 17.7 tt0 -64.79 148.3 51.51 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.707 0.289 . . . . 0.0 111.131 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.2 mtp180 -120.35 134.55 55.24 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.136 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 50.8 mtp180 -142.99 149.61 38.54 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.305 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.0 mt -114.46 133.76 59.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.242 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 23.8 mt -137.58 130.76 42.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.209 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.78 141.34 28.55 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.199 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -137.48 132.42 33.28 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.132 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.5 m -84.55 125.41 32.39 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.869 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 54.9 mtm180 -89.44 154.67 48.78 Favored Pre-proline 0 CA--C 1.529 0.155 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.116 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -74.61 121.07 6.98 Favored 'Cis proline' 0 C--N 1.351 0.663 0 C-N-CA 123.725 -1.365 . . . . 0.0 112.506 0.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.8 p -101.77 131.36 49.84 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.8 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp -78.28 144.56 36.03 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.825 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.514 ' CD1' HD13 ' A' ' 59' ' ' LEU . 50.8 t80 -56.77 -39.56 74.28 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.79 179.426 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.417 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -62.9 -36.01 81.95 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.15 179.696 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -67.92 -44.1 77.65 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 116.697 -0.228 . . . . 0.0 110.98 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.469 ' O ' HG23 ' A' ' 32' ' ' VAL . 31.6 t -63.84 -47.33 91.26 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.956 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.417 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 13.0 pt-20 -66.75 -35.08 79.27 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.085 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -56.43 -45.39 80.77 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.628 0.251 . . . . 0.0 110.852 179.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.662 ' O ' HG23 ' A' ' 35' ' ' VAL . 5.4 mmmt -68.25 -49.26 61.82 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.91 179.66 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 28' ' ' VAL . 40.1 t -61.25 -40.67 86.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.477 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.501 HG23 ' HB3' ' A' ' 38' ' ' GLN . 98.1 m -66.45 -41.72 88.67 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.069 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.3 m -72.63 -43.53 63.11 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 111.68 0.252 . . . . 0.0 111.68 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.662 HG23 ' O ' ' A' ' 31' ' ' LYS . 60.7 t -66.28 -44.06 91.33 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -179.304 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.535 ' HB2' HD11 ' A' ' 40' ' ' LEU . 18.0 m-85 -103.46 10.88 37.03 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -179.081 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.02 171.16 10.76 Favored Glycine 0 C--N 1.338 0.673 0 C-N-CA 120.736 -0.745 . . . . 0.0 113.057 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.501 ' HB3' HG23 ' A' ' 33' ' ' THR . 2.2 pt20 -120.29 159.19 48.65 Favored Pre-proline 0 N--CA 1.466 0.337 0 O-C-N 122.821 -0.223 . . . . 0.0 110.785 179.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -89.05 153.69 32.31 Favored 'Cis proline' 0 C--N 1.351 0.662 0 C-N-CA 123.846 -1.314 . . . . 0.0 113.477 0.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.535 HD11 ' HB2' ' A' ' 36' ' ' PHE . 48.3 mt -138.19 133.17 32.92 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.977 179.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.443 ' OD1' HD11 ' A' ' 52' ' ' LEU . 1.6 t0 -105.77 134.78 48.34 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.808 179.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.2 102.71 14.75 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.146 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.426 ' HA ' HD12 ' A' ' 52' ' ' LEU . 0.8 OUTLIER -101.5 122.12 43.22 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.229 -179.723 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.754 ' HB2' HD11 ' A' ' 53' ' ' LEU . 10.9 t80 -103.78 130.52 51.32 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.725 179.581 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 8.3 mtt -117.22 124.12 48.3 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.623 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -84.92 -61.92 1.66 Allowed 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.225 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -164.12 -64.12 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.694 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -112.83 -13.38 13.19 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.524 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.7 tp -120.44 143.76 48.32 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-O 120.69 0.281 . . . . 0.0 111.319 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.4 m -100.89 124.71 46.98 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.751 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.4 mt -118.59 133.51 65.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.001 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.589 HD23 ' HE2' ' A' ' 54' ' ' LYS . 14.1 tp -103.38 134.5 46.65 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.84 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.754 HD11 ' HB2' ' A' ' 44' ' ' TYR . 3.6 mp -84.89 84.31 7.75 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.751 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.589 ' HE2' HD23 ' A' ' 52' ' ' LEU . 67.5 mttm -90.28 -35.11 15.47 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.207 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -120.86 159.65 25.06 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.914 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.5 tm0? -60.16 -33.75 72.61 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.962 179.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.57 -40.61 79.32 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.093 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.67 -42.72 97.63 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.778 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.528 HD12 ' CD2' ' A' ' 53' ' ' LEU . 3.8 tp -68.46 -40.06 81.18 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.953 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.424 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.8 OUTLIER -61.33 -43.38 98.96 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.075 179.913 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.68 -35.74 79.39 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.85 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.64 -40.21 96.31 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.542 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.424 HD12 ' HA ' ' A' ' 60' ' ' ASP . 13.8 mt -64.16 -41.17 91.59 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 116.732 -0.213 . . . . 0.0 111.008 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -54.84 -40.13 69.29 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.028 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 44.4 mt -67.85 -42.01 85.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.811 179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.4 tp -65.54 -45.88 81.73 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.729 179.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.56 -39.63 77.12 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.105 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.1 mmt-85 -61.93 -34.37 75.96 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.213 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 42.5 t -84.8 105.26 15.45 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.907 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 85.6 p -67.59 -32.16 72.72 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.017 179.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 3.2 t -67.32 -43.14 82.35 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.953 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.42 120.98 25.68 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.103 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.46 -40.09 4.74 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.185 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 53.6 p -91.6 167.51 12.16 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.66 -0.246 . . . . 0.0 111.111 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.453 HD22 HD11 ' A' ' 77' ' ' ILE . 0.2 OUTLIER -107.57 131.12 54.69 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.23 -179.966 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -91.41 86.8 6.2 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.69 179.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.506 HD12 ' CG2' ' A' ' 6' ' ' ILE . 29.4 mt -117.95 129.3 74.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.004 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.99 117.58 32.44 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.836 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.508 HD21 ' HB3' ' A' ' 8' ' ' PHE . 0.5 OUTLIER -99.0 131.04 45.34 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.97 179.962 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 pp -122.93 130.57 53.0 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.705 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.421 ' HA ' HD23 ' A' ' 40' ' ' LEU . 39.4 t -75.99 135.7 40.0 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.767 179.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 34.8 tp60 -87.83 6.19 36.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.989 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -59.48 89.26 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.258 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.2 ttp85 -122.14 -49.47 2.06 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.59 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 68.88 111.01 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.519 179.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.468 ' HB3' ' CE1' ' A' ' 90' ' ' HIS . 6.2 tp -81.2 160.47 24.32 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.538 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -110.94 -54.86 2.56 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.299 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -104.96 157.16 17.41 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.805 0.336 . . . . 0.0 111.294 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.06 89.5 0.09 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.291 179.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.468 ' CE1' ' HB3' ' A' ' 86' ' ' LEU . 0.0 OUTLIER -146.43 -49.46 0.2 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.996 179.938 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 14.4 p80 -99.51 162.57 12.95 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.372 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -100.2 153.73 19.03 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.339 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.251 1.138 0 CA-C-O 118.587 -0.72 . . . . 0.0 111.226 179.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 . . . . . 0 N--CA 1.49 1.526 0 CA-C-O 120.689 0.28 . . . . 0.0 111.139 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.7 m 57.09 40.13 28.64 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.987 -179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -158.36 76.89 0.77 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.498 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 38.2 t -77.68 128.89 37.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.584 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 23.2 mtm180 -93.14 115.59 28.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.805 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.564 HD12 ' CD1' ' A' ' 19' ' ' PHE . 24.7 mt -108.31 128.68 63.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.856 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 39.4 mttt -106.23 126.99 52.9 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.009 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.416 ' HD1' HD23 ' A' ' 79' ' ' LEU . 89.2 m-85 -114.43 143.28 45.17 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.083 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -128.02 127.99 44.18 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.997 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.0 t-160 -143.1 118.88 10.51 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.602 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 58.4 37.29 25.79 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.345 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 91.57 -47.14 2.78 Favored Glycine 0 C--N 1.334 0.437 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.719 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.49 141.14 52.0 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.733 0.301 . . . . 0.0 110.92 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -125.06 149.75 47.49 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.323 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.51 139.46 50.5 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.948 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.4 mp -99.73 133.23 43.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.954 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 9.1 tp -129.46 137.58 56.51 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.395 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.87 131.38 35.83 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.994 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.745 ' CE2' HG22 ' A' ' 28' ' ' VAL . 6.6 m-85 -132.34 125.81 31.77 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.228 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.4 m -98.86 142.84 29.87 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.882 179.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 68.4 mtt180 -74.02 151.15 88.32 Favored Pre-proline 0 N--CA 1.464 0.245 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.948 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.75 125.87 12.47 Favored 'Cis proline' 0 C--N 1.352 0.715 0 C-N-CA 123.474 -1.469 . . . . 0.0 112.658 0.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.468 ' O ' HG13 ' A' ' 23' ' ' VAL . 11.9 p -89.61 114.94 28.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.077 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.592 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -99.66 137.16 38.53 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.106 -179.55 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.438 ' HD1' HD22 ' A' ' 59' ' ' LEU . 72.7 t80 -56.47 -40.31 74.64 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.141 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -63.57 -44.75 93.17 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.101 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -66.36 -44.28 83.62 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.374 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.745 HG22 ' CE2' ' A' ' 19' ' ' PHE . 43.1 t -65.35 -47.66 86.19 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.721 179.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -59.89 -42.66 94.31 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.095 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.82 -42.4 79.53 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.056 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.791 ' O ' HG23 ' A' ' 35' ' ' VAL . 13.9 mtpt -69.49 -49.63 52.92 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.028 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.547 HG23 ' O ' ' A' ' 28' ' ' VAL . 34.9 t -61.3 -40.55 86.49 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.441 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.498 HG23 ' HB3' ' A' ' 38' ' ' GLN . 88.5 m -59.3 -41.73 89.69 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.844 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 48.7 m -72.13 -31.76 66.3 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 111.464 0.172 . . . . 0.0 111.464 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 31' ' ' LYS . 48.1 t -63.95 -55.88 19.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 111.632 0.234 . . . . 0.0 111.632 -179.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.63 ' HB2' HD11 ' A' ' 40' ' ' LEU . 77.7 m-85 -97.56 -10.66 24.8 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.048 0.759 . . . . 0.0 113.048 -178.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.97 -172.41 24.55 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.475 -179.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.498 ' HB3' HG23 ' A' ' 33' ' ' THR . 1.4 pt20 -143.65 156.81 59.6 Favored Pre-proline 0 N--CA 1.465 0.277 0 O-C-N 122.83 -0.218 . . . . 0.0 111.338 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -81.44 153.31 80.08 Favored 'Cis proline' 0 C--N 1.35 0.636 0 C-N-CA 123.803 -1.332 . . . . 0.0 112.884 0.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.63 HD11 ' HB2' ' A' ' 36' ' ' PHE . 48.0 mt -136.01 149.08 48.69 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.029 179.647 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -116.0 120.23 38.47 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.793 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.434 HD12 ' OH ' ' A' ' 25' ' ' TYR . 73.2 mt -81.95 97.29 8.01 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.727 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -97.9 113.71 25.61 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.286 -179.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.752 ' HB2' HD11 ' A' ' 53' ' ' LEU . 14.1 t80 -98.85 123.56 43.19 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.717 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.4 mtt -126.23 131.86 51.85 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.673 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -76.91 -43.92 33.73 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.631 179.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -173.93 -49.85 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.605 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -119.34 -36.58 3.33 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.375 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.8 mp -95.26 134.14 38.36 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.827 0.346 . . . . 0.0 111.24 -179.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 98.1 p -105.04 121.2 43.29 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.844 179.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.4 mt -114.75 132.49 63.77 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.86 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.546 HD23 ' N ' ' A' ' 53' ' ' LEU . 4.9 tt -88.26 132.91 34.2 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.658 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.752 HD11 ' HB2' ' A' ' 44' ' ' TYR . 2.4 mt -103.01 94.67 5.67 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.69 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.532 ' HD2' HD22 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -110.07 27.66 9.38 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.486 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -173.45 164.92 4.65 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.919 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.42 -37.15 86.53 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.548 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -58.51 -40.9 84.16 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.653 -0.249 . . . . 0.0 110.909 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.551 ' HB3' HD23 ' A' ' 53' ' ' LEU . 20.3 m-20 -65.79 -43.79 87.67 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.781 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.579 HD12 HD13 ' A' ' 53' ' ' LEU . 7.2 tp -67.21 -41.76 85.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.802 179.401 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.593 ' HA ' HD12 ' A' ' 63' ' ' ILE . 5.4 t70 -63.85 -43.1 97.16 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.932 179.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.4 tttm -63.87 -32.13 73.54 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.411 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.77 -40.38 97.09 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.389 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.593 HD12 ' HA ' ' A' ' 60' ' ' ASP . 5.0 mt -64.42 -40.92 90.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.272 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.935 179.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -55.32 -34.95 64.62 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.001 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 41.7 mt -65.96 -40.92 88.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.085 179.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.593 HD22 HD21 ' A' ' 75' ' ' LEU . 12.4 tp -65.33 -45.02 85.93 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.768 179.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -56.97 -39.42 74.57 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.608 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -65.05 -32.76 74.64 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.203 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.5 t -70.04 146.5 50.95 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.809 0.338 . . . . 0.0 111.278 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 2.3 m -76.3 -34.82 59.06 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.426 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.3 p -77.79 -52.23 9.24 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.285 -179.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 13.9 ptt? 40.56 86.46 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.547 0 O-C-N 123.484 0.49 . . . . 0.0 112.223 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.09 82.78 2.07 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.961 0.41 . . . . 0.0 111.173 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.562 ' C ' HD22 ' A' ' 75' ' ' LEU . 0.4 OUTLIER 63.28 -179.37 0.15 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.44 179.856 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.593 HD21 HD22 ' A' ' 66' ' ' LEU . 3.5 mm? -122.31 122.47 39.15 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.077 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.3 mtt180 -83.4 93.81 7.84 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.004 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.3 mt -109.06 128.09 65.22 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.869 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.5 mp -103.64 126.45 50.79 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.192 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.416 HD23 ' HD1' ' A' ' 8' ' ' PHE . 3.8 pp -111.13 136.22 50.5 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.786 0.327 . . . . 0.0 111.169 179.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.1 mp -128.95 155.38 45.42 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.976 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.63 ' HA ' HD23 ' A' ' 40' ' ' LEU . 0.9 OUTLIER -85.9 141.44 29.57 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.162 179.916 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -87.85 5.66 39.23 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.995 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -145.26 76.54 1.49 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.531 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -112.05 24.09 13.02 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.638 -179.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -146.86 105.31 3.8 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.637 0.256 . . . . 0.0 111.09 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.417 ' O ' HD12 ' A' ' 86' ' ' LEU . 2.3 pp -89.29 115.83 27.06 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.809 0.337 . . . . 0.0 110.914 179.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -127.04 103.98 7.74 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.701 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -111.73 -174.89 2.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.884 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 4.4 t-160 -92.38 37.94 1.0 Allowed 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.326 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -100.79 74.07 1.62 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.953 0.406 . . . . 0.0 110.386 179.301 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 81.9 m-70 -65.13 156.12 32.66 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.198 -179.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 9.7 p-80 -99.47 108.84 21.39 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.806 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 17.3 p80 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.054 -0.974 . . . . 0.0 111.35 -179.758 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 120.597 0.237 . . . . 0.0 111.418 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.6 t -149.86 147.53 28.06 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.988 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 60.78 92.43 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.064 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.8 t -84.27 124.42 39.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.033 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.447 ' HG3' ' HB2' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -92.36 117.44 29.91 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.858 179.89 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.401 ' CG2' HD12 ' A' ' 77' ' ' ILE . 2.3 mt -103.64 130.42 54.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.12 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 tmtt? -110.55 114.42 27.82 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.711 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 12.2 p90 -113.34 146.96 38.58 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.079 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -124.48 143.95 50.37 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.106 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -140.39 111.84 7.3 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.678 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 37.4 m-20 54.58 34.49 21.4 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.645 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 104.75 -42.48 1.89 Allowed Glycine 0 C--N 1.334 0.459 0 C-N-CA 120.921 -0.657 . . . . 0.0 112.741 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.55 135.46 56.02 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.689 0.28 . . . . 0.0 111.076 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -115.05 154.08 29.52 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.596 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -151.79 136.37 16.98 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.157 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.42 ' O ' HD13 ' A' ' 17' ' ' ILE . 25.7 mt -114.38 126.56 71.94 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.135 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.42 HD13 ' O ' ' A' ' 16' ' ' ILE . 26.2 mm -130.63 131.13 64.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.12 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.447 ' HB2' ' HG3' ' A' ' 5' ' ' ARG . . . -95.66 134.05 39.01 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.13 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.44 ' CE2' HG13 ' A' ' 28' ' ' VAL . 9.5 m-85 -126.94 124.19 38.92 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.201 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -80.87 150.26 29.15 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.052 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.499 ' HD2' HG12 ' A' ' 23' ' ' VAL . 0.0 OUTLIER -91.42 152.01 43.26 Favored Pre-proline 0 CA--C 1.532 0.274 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.256 179.995 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -76.04 131.3 23.82 Favored 'Cis proline' 0 C--N 1.35 0.629 0 C-N-CA 123.233 -1.57 . . . . 0.0 112.318 -0.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.499 HG12 ' HD2' ' A' ' 21' ' ' ARG . 14.9 p -119.96 123.55 71.04 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.043 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.443 ' O ' HG23 ' A' ' 28' ' ' VAL . 39.7 mttp -91.79 151.09 20.76 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.08 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -62.65 -35.99 81.42 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.895 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -63.37 -44.66 94.14 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.987 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.67 -44.4 93.88 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.392 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 24' ' ' LYS . 39.4 t -67.73 -47.62 79.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 120.777 0.322 . . . . 0.0 110.685 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -63.42 -44.5 94.42 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.36 179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -56.33 -39.04 72.17 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.471 -179.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.791 ' O ' HG23 ' A' ' 35' ' ' VAL . 6.7 tttt -64.13 -47.58 79.39 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-O 120.64 0.257 . . . . 0.0 110.556 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 28' ' ' VAL . 20.7 t -63.52 -40.25 88.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.691 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.641 HG22 ' HG3' ' A' ' 38' ' ' GLN . 0.1 OUTLIER -59.28 -40.69 86.91 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 116.856 -0.156 . . . . 0.0 111.112 -179.932 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.9 m -72.47 -33.25 66.87 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 120.436 0.16 . . . . 0.0 111.088 179.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.791 HG23 ' O ' ' A' ' 31' ' ' LYS . 44.7 t -68.03 -53.1 32.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.485 ' HB2' HD11 ' A' ' 40' ' ' LEU . 30.6 m-85 -99.85 9.12 43.52 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -179.124 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.86 176.46 26.41 Favored Glycine 0 C--N 1.335 0.524 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.877 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.641 ' HG3' HG22 ' A' ' 33' ' ' THR . 1.3 mt-30 -124.35 158.54 60.95 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-O 120.467 0.175 . . . . 0.0 110.944 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -90.07 153.51 27.53 Favored 'Cis proline' 0 C--N 1.348 0.526 0 C-N-CA 123.901 -1.291 . . . . 0.0 113.175 0.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.578 HD23 ' HA ' ' A' ' 81' ' ' SER . 78.1 mt -138.54 148.35 44.14 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.942 179.573 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -115.16 123.58 49.28 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.663 179.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.548 HD23 ' HB3' ' A' ' 79' ' ' LEU . 81.1 mt -88.32 102.01 14.44 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.182 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -96.59 122.01 39.05 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.024 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.647 ' CZ ' ' HB1' ' A' ' 62' ' ' ALA . 15.2 t80 -104.3 119.04 38.07 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.47 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 27.6 mmm -94.32 130.97 40.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.768 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -82.5 -50.39 8.89 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.874 0.369 . . . . 0.0 110.348 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -172.41 -63.51 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.009 179.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.3 tt0 -107.14 -28.95 9.65 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.485 179.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.6 mt -109.12 162.98 13.75 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.919 0.39 . . . . 0.0 111.525 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.24 125.39 53.04 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.186 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.6 mm -116.61 132.7 65.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.944 179.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.495 HD12 ' O ' ' A' ' 42' ' ' LEU . 37.6 tp -94.75 126.55 40.14 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.841 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.444 HD21 ' CB ' ' A' ' 44' ' ' TYR . 15.6 mt -79.93 131.67 35.88 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.727 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.4 mmtt -108.04 -38.39 5.8 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.393 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 39.3 p30 -152.78 -172.3 4.2 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.041 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -55.98 -36.35 67.77 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.974 179.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.73 -44.99 70.35 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.859 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.64 -35.38 80.63 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.871 179.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.5 tp -72.91 -38.37 66.92 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.145 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -62.28 -43.38 98.96 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.263 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.3 ptpt -69.23 -30.77 68.99 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.808 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.647 ' HB1' ' CZ ' ' A' ' 44' ' ' TYR . . . -63.24 -39.4 94.49 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.294 179.751 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 21.6 mt -62.95 -40.89 90.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.838 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -55.82 -38.42 69.98 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.082 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 31.9 mm -68.77 -38.02 78.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.96 179.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.3 tp -62.28 -36.95 83.67 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.027 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.425 ' HA ' ' HG3' ' A' ' 72' ' ' MET . 14.6 t70 -57.9 -36.89 73.06 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.956 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 9.2 mtt-85 -65.74 -32.38 73.9 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.833 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 26.2 t -68.66 165.06 20.16 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.147 179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.95 -37.73 38.85 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.861 -179.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.82 -69.75 0.27 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.649 -0.251 . . . . 0.0 111.483 -179.295 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.425 ' HG3' ' HA ' ' A' ' 67' ' ' ASP . 2.0 ttm 53.83 30.49 11.47 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 120.759 0.314 . . . . 0.0 111.422 -179.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.7 mmpt? -117.8 -31.25 5.19 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.687 -0.233 . . . . 0.0 111.28 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 10.2 p -126.53 165.57 18.88 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.928 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.505 HD12 ' HE2' ' A' ' 44' ' ' TYR . 2.7 mm? -113.5 122.25 46.7 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.626 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 18.2 mtt-85 -82.95 93.62 7.57 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 120.837 0.351 . . . . 0.0 110.762 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.401 HD12 ' CG2' ' A' ' 6' ' ' ILE . 17.2 mt -126.11 131.43 71.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.133 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.8 tp -115.27 117.04 29.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.522 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.548 ' HB3' HD23 ' A' ' 42' ' ' LEU . 3.8 pp -110.57 135.41 51.25 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.768 0.318 . . . . 0.0 110.952 179.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.1 mt -135.74 154.14 51.34 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.677 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.578 ' HA ' HD23 ' A' ' 40' ' ' LEU . 6.2 t -89.67 145.07 25.49 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.984 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -88.23 6.0 38.9 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.42 ' O ' ' HB2' ' A' ' 84' ' ' ARG . 12.2 p30 -65.8 97.29 0.33 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.929 0.395 . . . . 0.0 111.632 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.42 ' HB2' ' O ' ' A' ' 83' ' ' ASP . 9.8 mmt85 69.4 117.44 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 122.889 0.475 . . . . 0.0 111.883 179.63 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -139.07 97.2 3.25 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.731 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -76.4 121.92 23.75 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.376 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -85.74 -71.9 0.51 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.393 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 17.1 p-80 -139.43 129.42 25.0 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.859 0.361 . . . . 0.0 110.998 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 15.6 p80 -99.37 -16.25 18.49 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.936 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.1 m80 66.32 164.08 0.18 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.64 0.257 . . . . 0.0 111.192 -179.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 2.4 t60 66.22 105.45 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.112 -179.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -141.83 151.96 43.24 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.19 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 9.6 p80 . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.134 -0.936 . . . . 0.0 111.081 179.801 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 . . . . . 0 N--CA 1.49 1.543 0 CA-C-O 120.665 0.269 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.3 m 63.51 167.69 0.14 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.314 -179.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 59.1 99.74 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.184 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.412 HG23 ' HG3' ' A' ' 21' ' ' ARG . 19.2 t -108.56 123.7 64.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.334 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.91 106.62 18.52 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.594 179.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 23.0 mt -107.09 124.69 63.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.123 -179.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.413 ' HG2' ' HA ' ' A' ' 76' ' ' ARG . 0.0 OUTLIER -101.6 116.98 33.96 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.764 179.544 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.61 ' CD1' HD23 ' A' ' 79' ' ' LEU . 20.5 m-85 -104.27 139.92 38.59 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.943 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.528 ' HB3' HD12 ' A' ' 78' ' ' LEU . 1.0 OUTLIER -123.37 132.25 53.91 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.95 -179.991 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 23.7 t-160 -142.12 117.05 9.92 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.786 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 57.97 35.62 25.44 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.335 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.06 -35.46 4.17 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.839 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -64.8 135.99 56.4 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.737 0.268 . . . . 0.0 110.932 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -117.35 140.18 49.9 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.22 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 25.1 mtt-85 -148.25 136.4 21.16 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.234 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.5 mt -105.14 125.04 60.24 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.233 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 26.0 mm -115.78 133.08 63.29 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.104 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.4 132.16 37.91 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.104 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -128.01 146.03 50.79 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.196 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.52 141.73 28.41 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.998 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.412 ' HG3' HG23 ' A' ' 4' ' ' VAL . 12.8 mtm180 -98.2 138.6 20.9 Favored Pre-proline 0 C--O 1.233 0.192 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.017 179.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -75.14 146.93 87.8 Favored 'Cis proline' 0 C--N 1.35 0.615 0 C-N-CA 123.773 -1.345 . . . . 0.0 112.446 0.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.415 ' O ' HG13 ' A' ' 23' ' ' VAL . 12.4 p -117.56 121.03 66.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 120.918 0.39 . . . . 0.0 111.008 179.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.423 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -75.58 130.62 39.1 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.875 -179.97 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.41 ' OH ' HD13 ' A' ' 42' ' ' LEU . 74.9 t80 -55.31 -35.76 65.48 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.983 179.501 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -60.72 -42.37 97.14 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.879 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -67.91 -43.12 79.96 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.919 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.663 ' O ' HG23 ' A' ' 32' ' ' VAL . 21.2 t -61.96 -47.02 95.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.95 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.443 ' HG3' ' N ' ' A' ' 30' ' ' HIS . 10.5 pt-20 -65.72 -42.27 91.26 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.927 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.443 ' N ' ' HG3' ' A' ' 29' ' ' GLU . 0.8 OUTLIER -56.47 -42.48 78.3 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.233 -179.971 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.823 ' O ' HG23 ' A' ' 35' ' ' VAL . 11.9 tttt -70.25 -49.16 52.72 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.051 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.663 HG23 ' O ' ' A' ' 28' ' ' VAL . 24.4 t -63.19 -40.75 90.22 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.388 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.724 HG23 ' HB3' ' A' ' 38' ' ' GLN . 60.3 m -58.56 -42.56 88.23 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.057 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.1 m -72.31 -35.29 68.61 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 120.484 0.183 . . . . 0.0 111.452 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.823 HG23 ' O ' ' A' ' 31' ' ' LYS . 49.1 t -67.69 -50.71 58.13 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -179.5 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.409 ' HB2' ' CD1' ' A' ' 40' ' ' LEU . 18.4 m-85 -103.97 10.92 36.01 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -179.05 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.63 172.4 9.39 Favored Glycine 0 CA--C 1.523 0.545 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.906 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.724 ' HB3' HG23 ' A' ' 33' ' ' THR . 5.1 pt20 -128.63 158.82 70.81 Favored Pre-proline 0 N--CA 1.463 0.213 0 CA-C-O 120.457 0.17 . . . . 0.0 110.709 179.571 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -87.57 153.88 41.46 Favored 'Cis proline' 0 C--N 1.35 0.638 0 C-N-CA 123.834 -1.319 . . . . 0.0 113.441 0.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.538 HD13 HD13 ' A' ' 79' ' ' LEU . 47.6 mt -138.93 155.69 47.84 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.703 179.637 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -114.54 134.12 55.27 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.842 0.353 . . . . 0.0 110.83 179.223 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.41 HD13 ' OH ' ' A' ' 25' ' ' TYR . 5.4 mp -91.39 103.75 16.35 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.943 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.413 ' CD2' ' HB2' ' A' ' 50' ' ' SER . 0.1 OUTLIER -111.15 122.18 47.22 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.337 -179.552 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.772 ' HB3' HD11 ' A' ' 53' ' ' LEU . 13.4 t80 -124.32 130.52 52.66 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.699 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.43 133.14 49.97 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.799 179.473 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -63.74 -56.23 17.21 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.735 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -157.43 -53.94 0.07 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.583 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -127.04 7.79 6.64 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.522 179.459 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.2 mt -131.39 138.65 49.21 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.474 0.178 . . . . 0.0 110.895 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.413 ' HB2' ' CD2' ' A' ' 43' ' ' HIS . 29.9 p -110.33 131.62 54.89 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.964 179.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 24.4 mt -130.28 134.62 62.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.974 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.8 133.55 33.98 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.925 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.772 HD11 ' HB3' ' A' ' 44' ' ' TYR . 0.2 OUTLIER -126.26 87.98 2.76 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.773 179.916 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -109.12 26.72 10.3 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.988 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -154.7 154.16 32.44 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.774 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.0 tp60 -60.55 -34.03 73.55 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.853 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -59.7 -50.63 73.12 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.02 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.05 -42.91 99.68 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.841 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 15.1 tp -60.93 -40.75 94.4 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.01 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.578 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.3 OUTLIER -61.63 -41.53 97.61 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.908 179.744 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 15.6 mtpt -63.5 -36.84 85.08 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.841 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.77 -36.45 83.13 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.106 179.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.578 HD12 ' HA ' ' A' ' 60' ' ' ASP . 39.3 mt -60.16 -44.01 94.33 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.962 179.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -54.4 -41.31 69.13 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.967 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 46.2 mt -65.18 -46.21 91.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.019 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.1 mt -63.06 -39.35 94.47 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.914 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -57.99 -37.33 74.05 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.11 179.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.3 mmt180 -62.25 -35.13 78.01 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.206 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 33.1 t -88.76 112.19 22.89 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.123 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.2 m -72.6 -33.72 66.91 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.898 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.7 p -74.82 -37.08 62.4 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.491 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -90.37 111.92 23.33 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.085 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.6 pttt -126.41 32.17 5.24 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.932 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 61.4 p -146.64 153.64 40.54 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.121 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.5 mp -104.07 116.76 32.81 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.12 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.413 ' HA ' ' HG2' ' A' ' 7' ' ' LYS . 6.4 ttm180 -90.17 91.86 8.71 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.698 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.8 mt -110.31 122.75 65.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.004 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.528 HD12 ' HB3' ' A' ' 9' ' ' GLU . 0.8 OUTLIER -105.83 117.56 34.34 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.767 179.773 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.61 HD23 ' CD1' ' A' ' 8' ' ' PHE . 3.6 pp -109.38 133.22 53.33 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.788 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.1 pp -118.07 154.62 31.76 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.841 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.444 ' HA ' HD23 ' A' ' 40' ' ' LEU . 25.9 m -97.06 135.57 38.86 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.76 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.86 5.71 42.53 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.584 179.249 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.2 t70 64.31 39.98 6.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.259 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 6.4 mtp180 68.11 127.83 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.23 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -70.61 91.24 0.79 Allowed 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.797 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.422 HD13 ' N ' ' A' ' 87' ' ' GLU . 0.2 OUTLIER -71.54 124.03 23.76 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.92 -179.886 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.422 ' N ' HD13 ' A' ' 86' ' ' LEU . 35.3 mt-10 -66.81 139.65 57.79 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.222 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -94.65 137.9 33.18 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.043 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.9 -173.71 3.99 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.969 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 38.5 t60 -97.44 145.18 26.44 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.228 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 72.59 -66.85 0.29 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.903 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -164.04 173.87 12.03 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.921 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.236 -0.887 . . . . 0.0 111.306 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 120.957 0.408 . . . . 0.0 111.469 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -153.29 160.67 42.78 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.263 179.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.414 ' OD1' ' HB1' ' A' ' 18' ' ' ALA . 3.7 t70 71.78 151.09 0.1 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.043 0.449 . . . . 0.0 111.207 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.4 t -128.32 137.77 56.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.152 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.55 116.08 28.49 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.432 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.698 HD13 ' HD2' ' A' ' 19' ' ' PHE . 4.0 mp -117.67 131.15 71.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.974 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 26.6 tttt -106.63 129.18 54.59 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.929 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -114.73 134.41 55.12 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.881 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.407 ' HB3' HD13 ' A' ' 78' ' ' LEU . 3.4 tt0 -119.21 123.85 45.33 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.962 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.4 t-160 -134.81 115.9 14.2 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.624 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 57.93 32.53 22.07 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.301 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 96.06 -34.77 4.72 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.995 -0.622 . . . . 0.0 112.699 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -65.02 136.41 56.75 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.703 0.287 . . . . 0.0 110.932 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 40.9 mtm-85 -108.61 138.78 44.36 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.158 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -132.81 127.83 35.39 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.798 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.8 mp -110.39 123.95 66.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.923 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 33.6 mt -137.44 131.81 44.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 121.029 0.442 . . . . 0.0 111.034 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.414 ' HB1' ' OD1' ' A' ' 3' ' ' ASP . . . -92.03 134.04 35.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.696 -0.683 . . . . 0.0 111.122 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.698 ' HD2' HD13 ' A' ' 6' ' ' ILE . 11.6 m-85 -116.21 119.26 35.2 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.767 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 93.2 p -74.9 131.18 40.51 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.912 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.3 mtm180 -73.95 151.78 88.6 Favored Pre-proline 0 N--CA 1.463 0.223 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.288 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.14 166.18 82.93 Favored 'Cis proline' 0 C--N 1.351 0.668 0 C-N-CA 123.562 -1.433 . . . . 0.0 112.845 0.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.5 p -152.63 153.17 9.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.239 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.551 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -134.31 164.17 28.01 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.491 -179.698 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.462 ' CD2' HD22 ' A' ' 59' ' ' LEU . 6.7 t80 -56.92 -44.65 82.66 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.264 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -58.09 -45.15 87.65 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.396 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.41 ' HB2' ' HG2' ' A' ' 24' ' ' LYS . 2.8 t70 -67.03 -44.42 80.28 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.572 -179.552 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.551 HG23 ' O ' ' A' ' 24' ' ' LYS . 40.0 t -67.9 -46.99 81.01 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.065 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -63.45 -41.49 98.65 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.388 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.6 m80 -56.68 -40.89 76.37 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.641 0.258 . . . . 0.0 111.059 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.797 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.4 OUTLIER -69.78 -49.07 56.44 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.257 -179.962 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 46.4 t -65.39 -42.57 93.83 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 CA-C-N 116.693 -0.231 . . . . 0.0 111.516 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.41 HG23 ' HB3' ' A' ' 38' ' ' GLN . 75.0 m -59.06 -39.67 82.79 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.725 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 29.7 m -72.15 -32.47 66.92 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 121.247 -0.181 . . . . 0.0 111.331 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.797 HG23 ' O ' ' A' ' 31' ' ' LYS . 60.4 t -66.87 -58.28 7.01 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 N-CA-C 111.435 0.161 . . . . 0.0 111.435 -179.652 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.493 ' HB2' HD11 ' A' ' 40' ' ' LEU . 33.0 m-85 -95.85 6.78 48.07 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -179.157 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.506 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 80.09 -176.29 54.72 Favored Glycine 0 C--N 1.336 0.546 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.693 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.41 ' HB3' HG23 ' A' ' 33' ' ' THR . 0.4 OUTLIER -131.28 155.87 80.91 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 120.561 0.22 . . . . 0.0 111.068 -179.9 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -90.61 153.72 25.34 Favored 'Cis proline' 0 C--N 1.349 0.601 0 C-N-CA 123.744 -1.357 . . . . 0.0 113.273 0.28 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.506 HD12 ' O ' ' A' ' 37' ' ' GLY . 21.5 mt -137.41 141.79 41.67 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.933 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -114.33 127.63 55.95 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.936 179.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 21.0 mt -92.66 112.84 24.94 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.829 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.486 ' CD2' HD12 ' A' ' 52' ' ' LEU . 10.0 t-160 -110.54 120.65 43.11 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.156 -179.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.873 ' HB2' HD21 ' A' ' 53' ' ' LEU . 1.2 t80 -88.76 130.33 35.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.842 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.6 mpp? -126.93 113.96 17.21 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.547 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -72.77 -53.98 10.13 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.733 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -176.68 -56.62 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.343 179.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -107.21 -26.79 10.91 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.536 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.487 HD23 ' N ' ' A' ' 50' ' ' SER . 0.9 OUTLIER -114.04 155.61 25.62 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.882 0.372 . . . . 0.0 111.495 -179.576 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.487 ' N ' HD23 ' A' ' 49' ' ' LEU . 0.7 OUTLIER -118.12 124.94 49.25 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.839 179.624 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 9.6 mt -113.87 133.12 60.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.046 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.486 HD12 ' CD2' ' A' ' 43' ' ' HIS . 0.2 OUTLIER -96.84 135.87 38.2 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.806 179.825 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.873 HD21 ' HB2' ' A' ' 44' ' ' TYR . 1.0 OUTLIER -95.33 76.68 3.4 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.617 179.915 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 3.0 pttp -77.37 -35.34 54.59 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.489 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -123.14 165.06 17.48 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.075 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.8 tm0? -59.94 -35.86 75.82 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.807 179.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -53.81 -49.88 67.37 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.91 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -59.17 -46.0 89.55 Favored 'General case' 0 N--CA 1.461 0.125 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.148 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.462 HD22 ' CD2' ' A' ' 25' ' ' TYR . 6.3 tp -66.15 -41.86 89.83 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.885 179.567 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.833 ' HA ' HD12 ' A' ' 63' ' ' ILE . 11.1 t0 -66.27 -42.34 88.62 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.395 -179.616 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -62.75 -36.52 83.31 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.45 179.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.816 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -63.81 -39.14 93.52 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.205 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.833 HD12 ' HA ' ' A' ' 60' ' ' ASP . 8.2 mt -64.53 -42.78 96.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.798 179.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.11 -37.69 67.18 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.945 179.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.816 HD12 ' HA ' ' A' ' 62' ' ' ALA . 9.5 mt -65.86 -41.69 90.6 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.879 179.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.497 HD13 HD12 ' A' ' 75' ' ' LEU . 5.9 tt -61.42 -44.21 97.53 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.865 179.541 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.79 -34.41 78.28 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.076 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -67.32 -32.63 73.72 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.406 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.7 t -103.92 109.05 20.66 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.294 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 47.5 t -77.7 -9.17 58.84 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.3 p -89.65 42.53 1.1 Allowed 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 120.758 0.313 . . . . 0.0 111.66 -179.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.81 -173.67 3.63 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.691 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.7 mttm -130.87 -69.05 0.66 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.652 0.263 . . . . 0.0 111.012 179.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -130.52 -173.01 2.95 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.058 -179.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.497 HD12 HD13 ' A' ' 66' ' ' LEU . 1.9 mp -91.9 121.54 33.59 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.452 179.574 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.9 tpt180 -76.81 80.34 3.41 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.002 0.429 . . . . 0.0 110.74 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.549 HD12 ' CG2' ' A' ' 6' ' ' ILE . 26.5 mt -103.93 123.24 57.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.754 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.407 HD13 ' HB3' ' A' ' 9' ' ' GLU . 4.0 mm? -103.29 117.29 34.17 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.819 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.1 pp -105.7 127.77 53.27 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.568 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.3 mp -119.82 127.62 52.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.127 -179.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -98.2 131.17 44.78 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.986 179.616 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.1 5.28 47.49 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.49 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -110.37 127.62 55.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.699 -179.753 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.51 92.26 4.0 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.843 0.354 . . . . 0.0 110.864 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -125.56 -177.87 4.05 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.829 179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 64.66 48.19 2.63 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.054 0.454 . . . . 0.0 110.882 -179.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -78.27 -45.11 23.67 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.826 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -164.62 175.18 10.03 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.623 179.721 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -85.02 -43.65 13.76 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.819 179.703 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER 63.0 -173.89 0.15 Allowed 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.228 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 9.8 p80 -106.1 29.18 6.96 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.103 179.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 21.4 p80 -168.57 133.59 1.67 Allowed 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.974 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.219 -0.896 . . . . 0.0 111.585 -179.95 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 121.039 0.447 . . . . 0.0 111.105 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.9 m -150.82 171.51 17.1 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.602 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -63.05 104.44 0.57 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.901 0.381 . . . . 0.0 110.87 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 23.2 t -78.48 130.08 36.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.348 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -87.76 123.58 32.71 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.928 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 3.1 mt -118.06 124.53 73.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.643 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.7 mttp -95.07 121.24 36.5 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.796 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -113.15 131.72 55.74 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.689 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.634 ' HB2' HD12 ' A' ' 78' ' ' LEU . 0.6 OUTLIER -119.22 127.91 53.71 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.182 -179.826 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 12.9 t-160 -130.98 117.19 18.84 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.522 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 56.33 32.27 20.16 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.548 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 96.26 -28.08 14.43 Favored Glycine 0 C--N 1.335 0.508 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.012 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.5 148.19 52.15 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.829 0.347 . . . . 0.0 111.273 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.7 ptp85 -109.07 142.59 39.56 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.113 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -141.87 139.95 32.76 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.227 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.1 mp -115.38 131.72 66.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.233 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.739 HD13 ' N ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -145.34 131.38 14.15 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.237 -179.944 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.739 ' N ' HD13 ' A' ' 17' ' ' ILE . . . -103.88 127.68 51.38 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.059 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.649 ' CD2' HD12 ' A' ' 17' ' ' ILE . 5.1 m-85 -113.28 120.7 42.09 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.087 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.3 m -82.55 128.53 34.39 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.931 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.0 mtm180 -78.33 156.8 78.53 Favored Pre-proline 0 N--CA 1.464 0.233 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.912 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.68 126.37 12.89 Favored 'Cis proline' 0 C--N 1.351 0.667 0 C-N-CA 123.566 -1.431 . . . . 0.0 112.667 -0.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.1 p -103.25 147.05 10.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.454 -179.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.412 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -110.66 146.11 36.77 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.109 -179.909 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 77.9 t80 -59.68 -39.6 85.04 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.629 179.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -43.83 98.14 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.837 179.682 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -64.96 -44.34 89.7 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.425 -179.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.673 ' O ' HG23 ' A' ' 32' ' ' VAL . 43.1 t -68.18 -47.3 78.89 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.125 0 CA-C-O 120.605 0.24 . . . . 0.0 111.156 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.435 ' HG3' HD11 ' A' ' 42' ' ' LEU . 1.4 tt0 -64.28 -45.45 87.98 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.136 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -58.95 -44.36 91.43 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 120.752 0.31 . . . . 0.0 110.596 179.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.721 ' O ' HG23 ' A' ' 35' ' ' VAL . 1.2 tttt -64.05 -49.47 72.23 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.228 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.673 HG23 ' O ' ' A' ' 28' ' ' VAL . 43.6 t -64.09 -41.05 91.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-N 116.764 -0.198 . . . . 0.0 111.323 -179.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 95.9 m -61.34 -39.5 90.79 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.993 179.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.3 m -72.42 -40.97 66.73 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 121.137 -0.225 . . . . 0.0 111.344 179.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.721 HG23 ' O ' ' A' ' 31' ' ' LYS . 47.3 t -64.84 -55.1 22.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.173 0 CA-C-O 120.67 0.271 . . . . 0.0 111.353 -179.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -85.95 -7.45 58.66 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -179.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.411 ' O ' HD12 ' A' ' 40' ' ' LEU . . . 86.03 177.15 50.01 Favored Glycine 0 C--N 1.337 0.613 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.571 -179.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.94 154.43 79.22 Favored Pre-proline 0 N--CA 1.465 0.301 0 CA-C-O 120.571 0.224 . . . . 0.0 111.044 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -86.91 153.52 45.12 Favored 'Cis proline' 0 C--N 1.349 0.59 0 C-N-CA 123.655 -1.394 . . . . 0.0 113.449 0.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.599 HD23 ' HA ' ' A' ' 81' ' ' SER . 32.6 mt -138.38 157.1 46.89 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.923 179.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -114.43 118.44 33.83 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.002 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.435 HD11 ' HG3' ' A' ' 29' ' ' GLU . 37.5 mt -79.84 100.1 7.84 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.892 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.4 m170 -103.73 112.26 25.13 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.874 0.369 . . . . 0.0 111.247 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -94.96 115.89 28.02 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.23 179.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.3 ttm -101.84 124.95 48.34 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.986 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -79.56 -41.1 27.95 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.712 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -171.81 -64.17 0.02 OUTLIER 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.334 179.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.81 -29.49 7.95 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.576 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -107.2 155.3 20.05 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.852 0.358 . . . . 0.0 111.291 -179.42 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.6 t -114.81 132.95 56.31 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.983 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 28.9 mt -125.39 134.34 67.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.694 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.5 tt -83.14 132.71 35.07 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.652 0.263 . . . . 0.0 111.093 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 17.1 mt -87.27 110.67 20.36 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.64 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.07 -64.06 1.18 Allowed 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.45 -179.545 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -136.13 -169.04 2.34 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.82 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -54.12 -30.77 50.1 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -54.14 -42.31 69.38 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.62 0.247 . . . . 0.0 111.119 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -66.42 -48.46 69.96 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.806 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.3 tt -64.23 -39.63 94.37 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.201 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.643 ' HA ' HD12 ' A' ' 63' ' ' ILE . 10.4 m-20 -61.81 -43.28 99.16 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.746 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.19 -36.33 83.7 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.643 179.311 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.68 -38.95 92.38 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.327 179.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.643 HD12 ' HA ' ' A' ' 60' ' ' ASP . 13.6 mt -64.35 -44.4 97.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.8 0.333 . . . . 0.0 110.642 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -56.48 -42.82 78.9 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.053 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 27.2 mt -69.19 -38.33 77.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.805 179.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 9.6 tp -60.5 -46.0 91.72 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.865 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -60.61 -36.15 77.87 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.718 179.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.6 ttm-85 -63.15 -33.0 74.52 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.28 179.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 31.1 t -72.3 150.9 43.14 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 120.664 0.269 . . . . 0.0 111.219 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 4.4 m -81.03 -33.04 33.86 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.493 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 41.0 p -74.07 -69.22 0.46 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.67 -0.241 . . . . 0.0 111.532 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.7 ttt 54.14 81.41 0.1 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.872 0.368 . . . . 0.0 111.016 -179.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.6 ptpt -128.78 85.63 2.35 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.001 -179.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.5 t 66.06 -179.83 0.2 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.384 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.7 mp -109.49 131.55 54.96 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.114 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.7 mtt85 -87.64 88.15 7.59 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.993 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 23.1 mt -122.39 127.31 75.06 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.132 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.931 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.634 HD12 ' HB2' ' A' ' 9' ' ' GLU . 0.6 OUTLIER -116.62 117.43 29.83 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.858 179.942 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.9 pp -96.2 127.97 42.69 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.804 0.335 . . . . 0.0 110.764 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.3 mp -112.79 147.51 36.76 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.353 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.599 ' HA ' HD23 ' A' ' 40' ' ' LEU . 1.3 p -95.1 147.47 23.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.824 179.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -85.47 5.46 31.12 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.227 -0.442 . . . . 0.0 112.03 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.72 70.89 3.52 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.922 0.392 . . . . 0.0 110.596 179.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 51.0 mtt180 -129.37 103.2 6.79 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.697 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -86.92 -70.19 0.63 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.099 -179.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.79 -31.84 69.97 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.809 179.747 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -79.27 98.5 6.68 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.197 -179.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -169.16 42.18 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.529 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -174.2 158.65 3.04 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.485 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -171.19 -53.12 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.653 179.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -166.76 133.58 2.44 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.399 179.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 45.9 t-80 68.64 107.8 0.05 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.499 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 16.6 p80 . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.517 -0.754 . . . . 0.0 111.13 179.376 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.709 0 CA-C-O 120.548 0.213 . . . . 0.0 111.529 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 54.9 m 65.88 159.84 0.13 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.456 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 65.34 116.08 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.145 -179.706 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 15.4 t -106.3 128.98 60.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.336 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -86.88 115.85 24.56 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.676 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.454 HG21 ' CZ ' ' A' ' 8' ' ' PHE . 20.1 mm -104.74 125.69 59.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.134 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.8 ttmt -100.92 116.15 32.11 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.636 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.454 ' CZ ' HG21 ' A' ' 6' ' ' ILE . 54.5 m-85 -109.55 132.61 53.97 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.717 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -119.51 133.61 55.6 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.196 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -141.11 116.11 9.84 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.81 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 34.8 m-20 56.05 35.66 25.99 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.339 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 94.45 -27.93 12.44 Favored Glycine 0 CA--C 1.525 0.677 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.963 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -64.55 150.16 47.35 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.715 0.257 . . . . 0.0 111.145 179.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.6 mtm-85 -125.75 143.82 50.89 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.397 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.23 132.36 16.34 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.165 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.5 mt -109.3 122.97 64.79 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.742 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 26.4 mt -133.08 130.18 57.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.122 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -97.54 131.18 44.38 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.098 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -112.96 117.04 30.97 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.745 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.85 140.1 47.37 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.846 -179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.47 150.91 95.68 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.978 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.74 132.44 26.91 Favored 'Cis proline' 0 C--N 1.35 0.606 0 C-N-CA 123.298 -1.543 . . . . 0.0 112.731 0.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.6 p -89.64 124.43 42.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.718 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.543 ' O ' HG23 ' A' ' 28' ' ' VAL . 6.4 mttt -113.21 134.47 54.57 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.941 -179.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -56.54 -46.46 80.65 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.076 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.22 -44.91 88.43 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.025 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -65.12 -44.67 87.96 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.304 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.543 HG23 ' O ' ' A' ' 24' ' ' LYS . 45.4 t -67.71 -47.26 80.54 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.777 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -59.71 -44.29 93.78 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.653 179.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.445 ' HA ' HG22 ' A' ' 33' ' ' THR . 3.7 t60 -57.89 -38.91 76.66 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.239 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.737 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.6 OUTLIER -69.82 -49.96 47.58 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.799 -0.182 . . . . 0.0 111.099 179.924 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.8 t -67.49 -43.33 87.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.445 HG22 ' HA ' ' A' ' 30' ' ' HIS . 5.9 t -59.8 -39.1 83.84 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.526 -179.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.3 m -72.12 -39.9 68.52 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 111.474 0.176 . . . . 0.0 111.474 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.737 HG23 ' O ' ' A' ' 31' ' ' LYS . 60.8 t -60.66 -55.75 22.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-O 120.508 0.194 . . . . 0.0 111.314 -179.524 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.539 ' CE2' HD11 ' A' ' 79' ' ' LEU . 40.9 m-85 -84.6 -20.06 32.04 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -179.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.4 178.22 41.38 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.6 -179.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -126.38 160.2 59.08 Favored Pre-proline 0 CA--C 1.53 0.201 0 CA-C-O 120.586 0.232 . . . . 0.0 110.85 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -83.82 146.34 52.36 Favored 'Cis proline' 0 C--N 1.351 0.686 0 C-N-CA 123.521 -1.45 . . . . 0.0 113.221 0.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.705 HD23 ' HA ' ' A' ' 81' ' ' SER . 17.3 mt -137.52 146.58 44.35 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.918 179.582 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -116.35 134.51 54.81 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.165 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.33 114.51 27.06 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.876 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -114.3 111.58 21.72 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.073 -179.516 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 16.8 t80 -93.4 121.9 35.26 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.276 179.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.1 ptt? -123.98 132.2 53.67 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.843 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -97.51 -47.89 5.49 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.358 179.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -163.72 -71.32 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.26 179.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -109.85 -25.72 10.17 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.453 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -103.6 140.74 37.14 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.76 0.314 . . . . 0.0 111.256 -179.607 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.3 m -112.37 132.25 55.11 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.698 179.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 30.0 mm -114.54 133.87 59.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.774 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.21 120.71 32.36 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.853 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.577 HD23 ' HB3' ' A' ' 58' ' ' ASP . 40.5 mt -104.61 125.27 50.58 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.57 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.2 ttmp? -128.5 -55.73 1.24 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.971 -179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.4 m-20 -104.53 174.58 5.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.792 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -58.98 -33.9 71.2 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.944 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.95 -48.53 67.28 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 120.579 0.228 . . . . 0.0 111.279 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.577 ' HB3' HD23 ' A' ' 53' ' ' LEU . 14.6 m-20 -63.26 -47.19 83.4 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.564 179.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 20.5 tp -63.43 -40.23 96.61 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.44 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -61.48 -43.3 99.1 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.607 -0.27 . . . . 0.0 110.813 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -34.72 78.76 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.814 179.291 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.99 -35.23 79.52 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.138 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 31.3 mm -59.64 -46.52 93.18 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.277 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.473 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -53.16 -43.51 67.09 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.849 179.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 32.3 mt -65.24 -43.15 95.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.311 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.461 HD21 ' O ' ' A' ' 74' ' ' SER . 0.1 OUTLIER -69.24 -48.09 62.85 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.886 0.374 . . . . 0.0 110.728 179.683 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -57.03 -40.33 76.52 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.6 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 37.3 ptt85 -69.02 -29.7 67.93 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 111.58 0.215 . . . . 0.0 111.58 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 64.7 p -76.12 116.75 17.13 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 120.732 0.301 . . . . 0.0 110.828 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 50.5 p -74.4 -48.97 24.49 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.246 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.17 -48.06 77.45 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.283 -179.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.06 145.64 49.77 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.016 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.9 mttp -136.66 -51.93 0.69 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.074 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.461 ' O ' HD21 ' A' ' 66' ' ' LEU . 0.7 OUTLIER -81.1 166.1 21.01 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.886 179.927 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -101.05 126.67 47.75 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.182 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.0 mtt180 -93.33 81.99 4.46 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.05 0.453 . . . . 0.0 110.851 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.3 mt -107.27 114.16 45.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.558 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.81 117.05 34.04 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.54 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.539 HD11 ' CE2' ' A' ' 36' ' ' PHE . 0.2 OUTLIER -104.72 135.89 45.26 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.881 179.91 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -139.97 154.7 47.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.83 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.705 ' HA ' HD23 ' A' ' 40' ' ' LEU . 60.5 m -70.73 142.96 51.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.079 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.536 ' O ' HD13 ' A' ' 86' ' ' LEU . 0.0 OUTLIER -85.93 5.57 32.47 Favored 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 179.765 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.44 56.95 4.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.084 0.468 . . . . 0.0 110.929 179.543 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 4.1 ttt180 -102.12 -40.73 6.69 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.48 179.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -165.16 -68.01 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.904 179.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.536 HD13 ' O ' ' A' ' 82' ' ' GLN . 3.4 mp 60.97 171.31 0.1 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.969 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -172.55 -51.78 0.02 OUTLIER 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.735 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -159.0 84.1 0.8 Allowed 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.245 179.717 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -114.29 -43.64 3.19 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.41 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -86.29 50.78 2.06 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 120.846 0.355 . . . . 0.0 111.106 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -163.04 35.9 0.1 Allowed 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.391 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -126.62 96.89 4.81 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.601 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.579 -0.724 . . . . 0.0 111.252 179.943 . . . . . . . . 1 1 . 1 stop_ save_