data_2lyd_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 2lyd _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 ' 5' ' ' SER . . . . . . . . . . . . . 90.7 p . . . . . 0 CA--C 1.527 0.067 0 CA-C-O 120.898 0.38 . . . . 1.74 110.725 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.4 mm -60.07 -46.3 94.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.279 -0.419 . . . . 1.21 110.182 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 36.2 m -58.85 -44.91 91.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.3 -0.409 . . . . 1.08 110.369 -177.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -59.22 -45.24 91.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.096 -0.502 . . . . 3.92 110.594 -178.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 96.9 mmm -58.2 -43.37 87.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.034 0.445 . . . . 2.07 110.417 -178.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.9 m120 -60.03 -49.46 77.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.156 -0.475 . . . . 1.76 110.202 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.4 tp -61.49 -30.07 70.38 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.593 -0.443 . . . . 1.08 111.368 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.05 -50.45 70.6 Favored 'General case' 0 C--N 1.333 -0.142 0 O-C-N 122.281 -0.262 . . . . 1.04 110.551 177.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.94 -42.01 84.01 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.078 0.466 . . . . 1.05 110.373 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 97.6 mt -54.05 -53.08 30.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.692 -0.685 . . . . 1.06 110.66 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 54.2 mttm -53.1 -26.46 16.51 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.551 0.574 . . . . 2.0 112.551 -178.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -59.49 -33.18 71.01 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 111.904 0.335 . . . . 3.89 111.904 -177.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 48.8 mm -104.48 -44.3 8.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.047 0.451 . . . . 1.12 110.089 -177.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -114.7 85.43 11.42 Favored Pre-proline 0 CA--C 1.534 0.338 0 CA-C-N 115.707 -0.679 . . . . 0.32 110.236 -176.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.07 -21.68 13.1 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 C-N-CA 121.399 1.399 . . . . 0.66 113.42 -176.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.0 p90 -100.01 17.2 21.62 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.347 0.869 . . . . 2.14 113.347 -174.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -94.31 118.97 32.38 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 109.09 -0.707 . . . . 1.08 109.09 173.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -108.8 -37.78 5.79 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 120.835 -0.346 . . . . 3.42 111.513 -172.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -128.33 147.96 50.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.873 0.368 . . . . 1.78 110.979 -176.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 58.7 mt -102.98 131.77 50.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.009 -0.542 . . . . 1.06 109.926 173.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.8 t -92.1 -47.22 14.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.916 0.389 . . . . 1.06 110.031 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -155.9 156.17 34.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.028 -0.533 . . . . 0.13 110.059 178.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 59.7 p -142.5 132.0 23.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.936 0.398 . . . . 0.84 110.58 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.2 t -106.52 129.72 54.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.925 -0.579 . . . . 0.83 109.797 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 30.2 m -54.2 -38.7 65.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.715 -0.675 . . . . 1.74 111.251 -172.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -152.72 127.8 9.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.178 0.513 . . . . 0.38 111.598 -178.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 99.3 t -145.19 143.85 21.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.004 -0.998 . . . . 1.03 109.539 -177.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -131.15 149.82 52.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.562 -0.29 . . . . 1.03 111.094 -178.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -99.2 131.48 45.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.277 0.56 . . . . 2.36 111.507 -177.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -127.44 143.91 51.13 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 115.946 -0.57 . . . . 0.96 110.823 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 86.4 m -121.89 148.56 44.58 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.24 -0.652 . . . . 1.08 109.24 177.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -109.45 131.95 54.59 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.999 0.428 . . . . 1.91 110.441 176.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 -103.78 114.17 28.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.878 -0.601 . . . . 0.48 109.718 176.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 86.6 p -68.92 -30.3 68.73 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.903 -0.59 . . . . 1.59 112.196 -176.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.8 p -62.4 -39.17 92.37 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.686 0.279 . . . . 1.8 110.932 -177.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -94.5 -21.51 18.84 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.607 0.595 . . . . 2.48 112.607 -179.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 69.82 44.49 0.84 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 121.414 0.626 . . . . 2.06 109.652 -177.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -149.87 160.87 43.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.614 -0.721 . . . . 1.93 111.09 -177.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 80.7 m95 -94.66 140.76 29.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.085 -0.507 . . . . 0.3 110.379 177.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -122.87 129.08 51.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.274 -0.421 . . . . 2.3 110.039 177.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 72.9 tttt -76.84 140.39 40.63 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.948 -0.39 . . . . 3.02 109.948 178.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.1 p -92.34 176.0 6.64 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.723 -0.391 . . . . 1.1 110.131 -179.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -86.17 12.94 8.66 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.638 0.607 . . . . 2.17 112.638 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.8 t -106.94 106.42 20.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-O 120.916 0.389 . . . . 1.11 110.381 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -130.39 113.02 13.82 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.575 -0.898 . . . . 0.29 108.575 174.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.66 176.48 38.97 Favored Glycine 0 CA--C 1.52 0.376 0 C-N-CA 120.191 -1.004 . . . . 0.11 112.361 -168.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -79.37 136.15 36.91 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.9 -0.778 . . . . 0.92 108.9 174.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -101.94 127.23 48.87 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.96 -0.296 . . . . 0.11 110.388 -175.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -130.61 142.19 50.45 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.785 0.326 . . . . 0.11 110.647 177.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 68.1 mt -101.55 127.1 55.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.241 -0.652 . . . . 1.03 109.241 171.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 13.8 m-30 -108.58 138.17 45.32 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.015 0.436 . . . . 0.81 111.285 -177.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 68.2 t60 -111.5 143.38 42.45 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.359 -0.837 . . . . 0.37 110.213 175.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -139.51 147.11 40.81 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.873 -0.603 . . . . 3.18 110.002 178.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -86.92 28.13 0.93 Allowed 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.15 -0.477 . . . . 2.04 112.136 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.52 160.79 38.57 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.735 -0.468 . . . . 1.04 109.735 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -63.98 131.16 94.87 Favored Pre-proline 0 CA--C 1.54 0.581 0 CA-C-O 118.483 -0.77 . . . . 2.53 110.059 -176.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -71.79 140.86 67.96 Favored 'Cis proline' 0 N--CA 1.498 1.752 0 CA-C-N 121.734 1.655 . . . . 0.84 111.58 -1.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -63.95 -40.43 96.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.278 -0.419 . . . . 2.25 111.079 -177.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -142.65 141.35 31.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.589 0.709 . . . . 0.34 111.044 -176.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.3 t -149.19 151.55 34.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.595 -0.729 . . . . 0.74 110.02 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 57.0 mt -115.62 138.98 44.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.43 . . . . 1.03 109.883 -177.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -131.85 142.14 49.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.787 -0.642 . . . . 2.19 111.1 -177.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.4 mt -120.33 128.99 76.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-O 121.235 0.54 . . . . 1.04 109.578 171.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -94.73 99.5 11.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.022 -0.99 . . . . 0.11 109.191 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.3 t-20 -72.53 105.84 4.36 Favored 'General case' 0 C--N 1.333 -0.138 0 O-C-N 123.65 0.594 . . . . 0.2 111.031 -174.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -73.87 -40.96 62.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.836 -0.62 . . . . 3.96 111.252 -171.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 70.9 mt -70.81 -45.23 64.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.359 -0.382 . . . . 1.09 111.644 -175.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 62.3 m-20 -95.06 -3.33 48.41 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 113.761 1.023 . . . . 2.0 113.761 -175.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.5 m 55.88 43.41 27.57 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-O 121.521 0.677 . . . . 1.79 110.49 177.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 34.5 m -127.45 148.87 50.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.441 -0.799 . . . . 1.1 110.618 -178.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.1 p -100.82 131.95 46.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.09 -0.505 . . . . 0.79 110.88 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -128.57 122.18 30.44 Favored 'General case' 0 N--CA 1.462 0.175 0 N-CA-C 110.204 -0.295 . . . . 2.29 110.204 175.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 p -125.57 149.95 30.59 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 116.358 -0.383 . . . . 1.92 111.004 -177.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -149.35 136.86 11.26 Favored Pre-proline 0 CA--C 1.538 0.488 0 CA-C-O 119.053 -0.499 . . . . 1.81 110.755 174.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.39 150.91 37.19 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 121.691 1.594 . . . . 0.39 112.378 178.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 64.4 mt -89.39 123.76 41.77 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 C-N-CA 120.657 -0.417 . . . . 1.08 110.47 178.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 40.4 p -99.35 159.02 15.31 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.073 -0.512 . . . . 1.25 110.065 175.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -98.41 7.75 61.94 Favored Glycine 0 CA--C 1.534 1.231 0 C-N-CA 120.97 -0.633 . . . . 0.5 113.597 -178.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.8 p -98.76 -5.31 31.56 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 117.947 0.873 . . . . 1.65 112.932 177.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.5 mt -68.99 141.18 54.98 Favored 'General case' 0 C--O 1.232 0.143 0 O-C-N 122.062 -0.398 . . . . 1.56 111.47 -177.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 57.2 tt0 -112.08 135.83 52.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.086 -0.507 . . . . 0.66 109.638 175.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.4 mt -113.84 158.38 21.1 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.03 0.443 . . . . 1.11 111.25 -175.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -148.71 145.68 27.78 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.814 -0.81 . . . . 0.77 108.814 176.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.1 t -114.63 109.3 18.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.009 0.433 . . . . 0.87 111.433 -177.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -106.82 103.54 47.61 Favored Pre-proline 0 CA--C 1.532 0.262 0 N-CA-C 108.672 -0.862 . . . . 1.29 108.672 169.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -62.08 141.86 90.29 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 CA-C-N 120.593 1.248 . . . . 0.72 111.457 -171.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -95.38 14.48 41.32 Favored 'Cis proline' 0 N--CA 1.497 1.724 0 CA-C-N 121.143 1.444 . . . . 0.5 113.649 -3.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -107.45 136.64 46.9 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 122.525 -0.11 . . . . 2.18 110.896 -175.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 36.5 tp -92.93 136.58 33.12 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 120.503 -0.479 . . . . 1.05 110.63 -176.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.7 tp -124.02 139.64 53.75 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.068 -0.515 . . . . 1.13 110.324 -173.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.1 p90 -143.96 153.95 42.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.822 0.344 . . . . 2.12 110.586 176.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 27.0 mtm105 -101.98 146.82 27.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.103 -0.499 . . . . 2.08 110.606 -178.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 16.5 t30 -129.97 168.43 16.69 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.667 0.746 . . . . 2.23 111.552 -177.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -47.08 145.8 2.01 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.566 -0.743 . . . . 2.32 112.233 -176.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 60.3 mtp180 63.82 30.91 14.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.168 -0.924 . . . . 4.07 112.146 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.2 m 65.19 35.12 8.01 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.949 0.404 . . . . 1.69 111.524 167.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 36.2 mtp180 -98.28 151.98 19.91 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.307 -0.627 . . . . 3.12 109.307 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 72.3 mt -117.12 127.52 74.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 121.153 0.502 . . . . 1.06 110.068 -176.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 81.0 mtt85 -138.41 150.33 46.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.66 -0.7 . . . . 2.18 109.495 178.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.7 168.77 26.26 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 120.787 -0.72 . . . . 0.24 111.81 -176.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -125.27 135.02 52.1 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.279 -0.46 . . . . 2.37 110.269 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 46.5 t90 -107.46 131.01 54.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.012 -0.54 . . . . 0.99 109.899 177.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -117.17 149.77 39.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.792 0.329 . . . . 2.06 110.602 -179.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -52.63 -37.71 58.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.137 -0.483 . . . . 2.1 111.441 176.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.5 t-20 -131.28 135.2 47.1 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.467 -0.333 . . . . 0.41 110.53 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.7 t -61.97 -41.99 98.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.271 -0.422 . . . . 1.78 111.084 -177.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -60.03 -43.68 95.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.432 0.634 . . . . 0.97 110.096 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -56.43 -44.59 80.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.635 -0.711 . . . . 0.16 109.996 178.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 38.0 t -59.83 -38.5 82.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.494 -0.775 . . . . 0.9 110.732 177.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -59.11 -46.32 88.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.917 0.389 . . . . 1.63 110.527 -177.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 -59.54 -49.17 78.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.141 0.496 . . . . 3.9 110.599 -177.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 27.5 mm -58.49 -46.51 89.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.42 0.629 . . . . 1.03 109.973 -178.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 20.9 m -58.65 -40.9 84.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.97 -0.559 . . . . 1.17 110.682 -177.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -56.9 -42.43 92.34 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 110.688 -0.965 . . . . 0.18 110.688 -179.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 16.0 mt -57.79 -50.05 74.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.438 0.637 . . . . 1.03 110.275 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 53.1 t -58.46 -43.62 87.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.546 -0.752 . . . . 1.06 110.109 -177.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 24.4 m120 -57.45 -41.51 80.65 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.3 -0.409 . . . . 1.78 110.634 -178.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.43 -45.63 95.5 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 111.184 -0.766 . . . . 0.29 111.184 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 66.8 mt -57.89 -41.7 83.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.899 0.38 . . . . 1.06 110.621 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 88.5 mt . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.007 -0.542 . . . . 1.26 110.749 -179.296 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 8.4 mt . . . . . 0 CA--C 1.53 0.197 0 N-CA-C 109.59 -0.522 . . . . 1.11 109.59 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -79.06 139.79 15.37 Favored 'Trans proline' 0 N--CA 1.492 1.386 0 C-N-CA 121.057 1.171 . . . . 0.72 111.08 174.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -97.17 125.78 44.54 Favored Pre-proline 0 CA--C 1.535 0.391 0 CA-C-O 118.512 -0.756 . . . . 2.88 109.955 179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -78.18 169.04 20.9 Favored 'Trans proline' 0 N--CA 1.497 1.721 0 C-N-CA 121.311 1.34 . . . . 1.07 112.015 176.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -65.18 157.08 59.46 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 121.328 1.352 . . . . 0.99 111.396 176.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 9.8 tt -50.0 -32.82 16.14 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.131 0.419 . . . . 2.45 112.131 -176.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 58.4 t80 -54.28 -36.16 63.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.85 0.357 . . . . 4.15 111.418 -176.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 12.1 t90 -61.75 -48.18 81.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.37 -0.377 . . . . 0.49 110.448 -176.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -62.45 -47.93 81.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.042 0.449 . . . . 2.44 110.574 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -59.45 -44.49 92.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.142 -0.481 . . . . 2.96 110.905 -177.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -59.03 -46.39 88.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.249 -0.432 . . . . 1.53 110.654 -176.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.53 -48.0 83.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.113 0.482 . . . . 1.09 110.631 -177.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 115.974 -0.557 . . . . 2.64 111.141 -176.818 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.6 p . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.89 0.376 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mm -60.39 -47.18 93.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.0 0.429 . . . . 0.0 110.211 -178.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.6 m -58.94 -43.88 91.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.565 -177.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.0 mtp85 -59.75 -44.95 93.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.626 -178.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 97.2 mmm -58.24 -43.92 88.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.005 0.431 . . . . 0.0 110.425 -178.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -60.7 -49.69 76.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.271 -178.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.6 tp -59.33 -32.9 70.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.05 -179.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.69 -50.68 68.26 Favored 'General case' 0 C--N 1.332 -0.166 0 O-C-N 122.294 -0.254 . . . . 0.0 110.906 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.75 -41.71 82.45 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.99 0.424 . . . . 0.0 110.502 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 94.9 mt -54.18 -53.07 31.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.715 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -52.88 -21.34 4.16 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -57.91 -35.4 71.01 Favored 'General case' 0 C--N 1.332 -0.169 0 O-C-N 122.33 -0.231 . . . . 0.0 111.477 -177.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 45.8 mm -113.01 -39.78 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-O 120.776 0.322 . . . . 0.0 110.554 -177.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -117.29 77.2 9.65 Favored Pre-proline 0 CA--C 1.535 0.367 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.162 -178.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -55.69 -21.49 32.13 Favored 'Trans proline' 0 N--CA 1.498 1.738 0 C-N-CA 121.512 1.475 . . . . 0.0 113.396 -175.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -88.69 8.76 27.04 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -174.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -86.81 124.77 33.42 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 174.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -105.61 -39.35 6.12 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.798 0.332 . . . . 0.0 111.173 -174.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -134.72 144.78 47.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.97 0.414 . . . . 0.0 111.064 -176.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 24.4 mt -96.34 131.32 43.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 172.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.1 t -91.49 -47.19 14.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 0.0 109.929 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -153.03 152.01 30.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.844 178.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.9 p -139.86 131.94 27.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.083 0.468 . . . . 0.0 110.958 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 45.0 t -105.37 126.9 52.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.654 176.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.1 m -54.4 -38.9 66.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.191 -172.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -151.31 127.04 10.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.217 0.532 . . . . 0.0 111.501 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 96.5 t -144.91 142.31 22.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.526 -177.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -131.53 149.87 52.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.203 -178.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -100.68 131.33 46.64 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.656 -176.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -127.16 144.45 51.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.819 178.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 74.7 m -122.46 149.48 43.81 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -109.48 131.93 54.61 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.854 0.359 . . . . 0.0 110.316 175.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.0 t-20 -103.92 114.7 29.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.73 176.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 84.8 p -68.6 -31.41 70.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.058 -177.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.2 m -61.91 -38.61 89.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.686 0.279 . . . . 0.0 110.964 -177.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -95.1 -21.44 18.54 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -178.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 51.0 t30 68.95 45.65 0.92 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-O 121.411 0.624 . . . . 0.0 109.343 -177.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 76.8 tt0 -151.49 150.58 30.54 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.281 -176.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 78.2 m95 -85.32 138.46 32.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.871 175.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -122.05 126.39 48.37 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 177.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -73.8 139.71 45.35 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 177.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.7 p -92.31 175.42 6.85 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.181 -178.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.6 p30 -86.51 13.71 7.98 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.1 t -108.5 106.42 20.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 121.047 0.451 . . . . 0.0 110.342 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -131.49 112.1 12.36 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 174.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.64 176.56 38.95 Favored Glycine 0 CA--C 1.522 0.48 0 C-N-CA 120.125 -1.036 . . . . 0.0 112.283 -168.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -77.47 135.85 38.3 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 174.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -103.04 126.96 50.45 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.368 -175.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -130.04 142.07 50.66 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.744 0.307 . . . . 0.0 110.72 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 68.3 mt -101.59 126.9 55.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 171.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 14.2 m-30 -108.65 138.56 44.77 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.995 0.426 . . . . 0.0 111.552 -177.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -108.82 143.34 38.13 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.976 173.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -140.49 146.34 38.05 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.111 178.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -86.88 28.11 0.93 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 112.1 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.97 162.77 38.22 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -63.91 129.88 94.13 Favored Pre-proline 0 CA--C 1.539 0.528 0 CA-C-O 118.448 -0.787 . . . . 0.0 110.002 -177.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -73.46 140.93 70.01 Favored 'Cis proline' 0 N--CA 1.498 1.793 0 CA-C-N 121.867 1.703 . . . . 0.0 111.681 -1.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -63.09 -40.73 98.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.925 -177.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -143.02 140.51 31.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.401 0.619 . . . . 0.0 110.944 -177.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.5 t -149.81 152.31 34.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.281 -178.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 53.1 mt -116.13 138.65 45.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 -177.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -131.87 142.09 49.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.135 -176.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.6 mt -121.05 131.47 72.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.186 0.517 . . . . 0.0 109.833 172.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -98.71 99.56 10.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.902 -1.044 . . . . 0.0 109.335 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.4 t-20 -73.2 107.71 5.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.271 0.558 . . . . 0.0 111.268 -174.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -73.47 -39.38 64.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.272 -172.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 70.2 mt -73.23 -45.19 57.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.719 -174.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -95.05 -3.42 48.27 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.753 1.019 . . . . 0.0 113.753 -175.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.8 m 55.95 43.14 27.82 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 121.477 0.656 . . . . 0.0 110.49 177.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.8 m -130.13 149.02 52.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.332 -178.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.0 p -102.66 139.98 37.54 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.094 -179.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -134.64 122.25 22.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.185 177.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.7 p -125.55 148.49 30.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.038 -177.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 55.5 tt0 -148.66 137.07 11.62 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-O 119.063 -0.494 . . . . 0.0 110.622 175.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.53 150.95 36.63 Favored 'Trans proline' 0 N--CA 1.498 1.744 0 C-N-CA 121.67 1.58 . . . . 0.0 112.268 178.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 63.4 mt -89.42 121.07 39.15 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 C-N-CA 120.711 -0.395 . . . . 0.0 110.363 178.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 71.0 p -99.1 160.8 14.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.052 176.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -97.38 7.31 63.83 Favored Glycine 0 CA--C 1.533 1.215 0 C-N-CA 120.877 -0.678 . . . . 0.0 113.607 -178.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.7 p -99.04 -3.75 34.04 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 117.927 0.863 . . . . 0.0 113.015 177.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.0 mt -68.36 144.45 54.77 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 118.1 0.409 . . . . 0.0 111.166 -177.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.1 tt0 -115.97 135.84 53.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.78 176.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 60.0 mt -117.23 157.74 25.51 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.896 0.379 . . . . 0.0 110.854 -176.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -150.14 143.36 25.0 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.0 t -98.59 109.11 21.92 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.491 178.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -106.87 103.75 48.64 Favored Pre-proline 0 C--N 1.328 -0.329 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 172.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -70.4 143.11 46.82 Favored 'Trans proline' 0 N--CA 1.497 1.702 0 CA-C-N 120.541 1.229 . . . . 0.0 112.027 -171.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -90.94 14.59 50.13 Favored 'Cis proline' 0 N--CA 1.5 1.858 0 CA-C-N 121.041 1.407 . . . . 0.0 113.481 -3.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -95.97 172.28 8.1 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.531 0.205 . . . . 0.0 110.627 -177.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.8 tp -113.98 135.01 54.46 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 172.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.0 tp -126.02 139.19 53.62 Favored 'General case' 0 C--N 1.333 -0.114 0 N-CA-C 110.428 -0.212 . . . . 0.0 110.428 -173.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 50.8 p90 -145.97 154.43 41.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.965 0.412 . . . . 0.0 110.627 174.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.6 mtm180 -104.75 149.13 25.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.729 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -129.96 165.56 21.87 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.856 0.836 . . . . 0.0 111.549 -178.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -48.45 146.54 2.86 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.524 -0.762 . . . . 0.0 112.1 -176.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 38.8 ttp180 65.23 30.95 11.08 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.289 -0.869 . . . . 0.0 112.041 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 46.9 t 66.05 35.23 6.43 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.858 0.361 . . . . 0.0 111.538 166.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 18.7 mmm180 -97.89 148.24 23.63 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 76.9 mt -113.66 128.55 70.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -178.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -138.75 150.31 45.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.535 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.33 169.32 25.89 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 111.494 -0.642 . . . . 0.0 111.494 -175.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -125.19 139.87 53.36 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 120.951 0.405 . . . . 0.0 110.909 -177.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 65.5 t90 -106.22 125.39 50.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.533 174.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 67.7 m-85 -117.19 140.31 49.69 Favored 'General case' 0 C--N 1.33 -0.258 0 O-C-N 123.262 0.351 . . . . 0.0 110.539 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -50.49 -39.71 49.17 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.908 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -131.72 137.26 48.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.664 0.268 . . . . 0.0 110.372 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 84.3 p -62.28 -42.28 99.21 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.144 -177.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -59.01 -44.19 91.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.431 0.634 . . . . 0.0 109.961 178.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -55.94 -44.22 78.18 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.152 178.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 49.2 t -60.07 -40.65 90.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.594 178.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -59.09 -46.1 89.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.904 0.383 . . . . 0.0 110.634 -176.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.0 mtm180 -61.04 -49.38 77.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.817 -177.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 26.8 mm -58.65 -44.3 89.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.996 0.427 . . . . 0.0 109.963 -178.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.8 m -59.36 -44.19 92.74 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.667 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.59 -44.36 93.92 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 -178.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.2 mt -59.03 -49.09 79.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.145 0.498 . . . . 0.0 110.607 -178.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 56.9 t -58.97 -42.66 86.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.164 -178.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -57.74 -42.75 84.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.881 0.372 . . . . 0.0 110.552 -178.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.65 -42.28 99.73 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 -179.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.4 mt -62.69 -43.12 99.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.774 0.321 . . . . 0.0 111.105 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 65.4 mt . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.458 -176.509 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 17.7 mt . . . . . 0 CA--C 1.53 0.198 0 CA-C-O 119.354 -0.355 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.17 139.87 15.25 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 C-N-CA 121.163 1.242 . . . . 0.0 110.981 173.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 49.0 mmtt -97.11 125.76 44.74 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-O 118.892 -0.575 . . . . 0.0 109.982 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -75.8 154.13 38.58 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 121.392 1.394 . . . . 0.0 111.381 171.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -51.68 152.11 13.5 Favored 'Trans proline' 0 N--CA 1.496 1.633 0 C-N-CA 121.271 1.314 . . . . 0.0 111.621 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.3 tp -50.0 -29.74 9.23 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -177.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -55.15 -37.27 66.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.815 0.34 . . . . 0.0 111.223 -177.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 35.5 t90 -60.89 -48.03 83.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.181 -177.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -61.7 -49.44 76.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.088 0.471 . . . . 0.0 110.482 -177.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -59.96 -45.44 92.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.974 -176.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -59.44 -47.33 85.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.713 -175.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.73 -48.56 81.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.823 -176.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.144 -175.592 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.2 t . . . . . 0 CA--C 1.526 0.045 0 CA-C-O 120.954 0.407 . . . . 0.0 110.594 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.2 mm -59.87 -46.07 94.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.133 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.2 m -58.84 -44.71 90.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.449 -177.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -59.7 -45.13 93.05 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.66 -178.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 89.6 mtp -58.25 -42.92 87.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.996 0.427 . . . . 0.0 110.416 -178.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -60.13 -49.97 75.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.216 -178.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.2 tp -61.31 -30.5 70.54 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.631 -0.427 . . . . 0.0 111.342 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.57 -49.78 73.89 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 122.219 -0.301 . . . . 0.0 110.505 178.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.16 -42.32 85.74 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.032 0.444 . . . . 0.0 110.336 178.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 95.6 mt -54.24 -52.98 33.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.755 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -55.62 -26.55 44.71 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -177.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 52.8 mttm -59.98 -30.82 69.37 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -177.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.9 mm -107.63 -42.49 6.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.843 0.354 . . . . 0.0 110.319 -176.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -114.7 84.6 10.35 Favored Pre-proline 0 CA--C 1.533 0.315 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.473 -176.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -53.11 -22.95 20.72 Favored 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 121.528 1.486 . . . . 0.0 113.338 -177.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.2 p90 -97.51 22.07 9.39 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 -175.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -107.89 122.4 46.72 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 171.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 46.1 mtmt -116.71 -30.14 5.88 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -174.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -128.84 142.25 51.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.763 0.316 . . . . 0.0 110.862 -178.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 57.6 mt -98.98 132.42 44.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.85 174.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 43.6 t -94.41 -47.14 13.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.195 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -154.05 153.76 32.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.181 178.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.5 p -141.72 131.99 24.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.943 0.401 . . . . 0.0 110.749 178.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 38.3 t -106.98 129.15 54.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.726 176.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.8 m -54.27 -38.22 65.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.252 -172.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -152.73 126.66 9.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.141 0.496 . . . . 0.0 111.759 -178.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 99.3 t -145.19 142.64 22.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.534 -177.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.93 149.89 50.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.68 -0.236 . . . . 0.0 111.022 -179.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -98.72 132.58 43.99 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.33 0.586 . . . . 0.0 111.602 -177.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -129.54 143.94 51.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.666 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 96.5 m -121.98 149.56 43.29 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -110.91 131.99 54.58 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.997 0.427 . . . . 0.0 110.535 177.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 -104.41 114.91 29.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.811 176.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.1 m -67.84 -32.69 73.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.987 -177.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.0 t -60.27 -39.48 86.96 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.719 0.295 . . . . 0.0 110.9 -177.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -94.45 -21.42 18.92 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 26.5 t30 69.41 43.78 1.0 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.348 0.594 . . . . 0.0 109.739 -177.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.5 mt-10 -150.43 161.83 41.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.124 -177.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 81.8 m95 -94.89 140.0 30.54 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.416 177.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -119.75 126.42 51.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.477 . . . . 0.0 109.951 176.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.9 ttpm? -74.4 140.12 44.51 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 178.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 74.3 p -92.25 176.46 6.48 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.412 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -88.36 13.39 11.81 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 45.2 t -108.1 106.42 20.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 121.03 0.443 . . . . 0.0 110.475 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -129.35 112.75 14.16 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 174.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.56 38.96 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 120.114 -1.041 . . . . 0.0 112.237 -168.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.38 136.42 37.67 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 175.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -100.91 126.28 47.53 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.178 -175.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -129.58 142.25 50.79 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.744 0.307 . . . . 0.0 110.55 177.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 68.9 mt -101.61 126.87 55.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 171.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 14.3 m-30 -108.58 137.48 46.46 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.827 0.346 . . . . 0.0 111.229 -177.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 50.9 t60 -112.07 143.25 43.39 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.004 174.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 33.8 tpt85 -142.21 147.89 37.29 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.268 177.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -86.94 28.21 0.93 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.218 -0.447 . . . . 0.0 112.077 -179.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.02 169.79 23.77 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -64.01 125.25 87.58 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.982 -178.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -78.34 140.97 63.2 Favored 'Cis proline' 0 N--CA 1.496 1.642 0 CA-C-N 121.911 1.718 . . . . 0.0 111.843 -1.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -61.54 -42.22 98.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.903 -177.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -143.63 139.8 29.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.353 0.596 . . . . 0.0 110.891 -177.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.3 t -149.9 151.26 33.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.303 -177.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 48.1 mt -113.47 137.67 45.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 -178.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -131.82 142.2 49.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.355 -176.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.4 mt -120.66 130.35 74.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 121.202 0.525 . . . . 0.0 109.662 172.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -96.96 99.56 11.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.937 -1.029 . . . . 0.0 109.205 179.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -71.89 107.58 4.72 Favored 'General case' 0 C--N 1.332 -0.181 0 O-C-N 123.666 0.604 . . . . 0.0 111.089 -174.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 78.3 ttt-85 -73.33 -42.41 62.33 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.397 -171.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 48.7 mt -72.27 -45.09 61.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.633 -175.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -95.08 -3.22 48.55 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 -175.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 69.7 p 50.93 42.64 28.44 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.511 0.672 . . . . 0.0 111.183 177.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 32.4 m -127.67 135.53 50.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.334 -179.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.3 p -85.36 136.81 33.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.354 -178.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -132.71 122.17 24.2 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.347 175.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 13.2 p -125.59 150.31 30.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.209 -178.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -148.28 136.37 11.2 Favored Pre-proline 0 CA--C 1.537 0.466 0 CA-C-O 119.106 -0.473 . . . . 0.0 110.567 174.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -75.43 151.01 37.13 Favored 'Trans proline' 0 N--CA 1.498 1.774 0 C-N-CA 121.704 1.602 . . . . 0.0 112.403 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 64.5 mt -90.78 125.44 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.151 177.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 40.6 p -98.49 160.29 14.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.264 176.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -82.35 -22.09 59.36 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 121.218 -0.515 . . . . 0.0 113.124 -176.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.9 p -87.02 10.15 17.39 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -177.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.7 mt -66.88 131.82 46.7 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 118.109 0.413 . . . . 0.0 111.098 -177.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -112.35 135.8 52.6 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.901 176.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 70.5 mt -119.23 157.83 27.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.023 0.439 . . . . 0.0 111.087 -175.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -144.08 135.71 25.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.473 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.0 t -97.72 109.33 22.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.994 0.426 . . . . 0.0 111.241 -177.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 12.6 mt-30 -106.57 129.22 24.79 Favored Pre-proline 0 CA--C 1.534 0.362 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 173.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -79.26 128.95 8.42 Favored 'Trans proline' 0 N--CA 1.494 1.551 0 CA-C-N 120.651 1.268 . . . . 0.0 111.878 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -98.71 19.25 26.22 Favored 'Cis proline' 0 N--CA 1.5 1.889 0 CA-C-N 122.121 1.793 . . . . 0.0 113.026 -6.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -112.58 132.94 54.88 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.713 0.292 . . . . 0.0 111.371 -171.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 35.5 tp -90.22 135.04 33.91 Favored 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.702 -172.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.5 tp -123.53 143.01 50.46 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.519 -175.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 33.8 p90 -143.38 152.27 41.4 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.835 0.35 . . . . 0.0 110.199 175.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 27.0 mtm180 -104.64 144.58 31.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.714 -176.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -129.1 167.76 17.09 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.915 0.864 . . . . 0.0 111.619 -177.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 52.1 tt0 -48.52 149.33 1.68 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.983 -176.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 62.05 30.96 18.03 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.212 -0.904 . . . . 0.0 112.172 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 7.5 m 65.11 35.29 8.04 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.842 0.354 . . . . 0.0 111.541 166.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 90.0 mtt-85 -97.48 147.02 24.66 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 73.0 mt -115.57 124.19 71.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 -177.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 81.1 mtm180 -137.24 150.32 47.76 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -146.6 169.44 27.8 Favored Glycine 0 CA--C 1.523 0.555 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.956 -175.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -125.15 136.53 53.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.165 -0.517 . . . . 0.0 110.534 -178.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 70.4 t90 -106.57 125.82 51.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.597 176.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -113.47 146.36 39.71 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.837 0.351 . . . . 0.0 110.646 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -52.32 -36.13 52.51 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.569 177.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 33.1 t-20 -133.21 133.75 43.15 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.786 0.327 . . . . 0.0 110.491 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 22.9 m -61.21 -40.64 94.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.169 -178.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -61.0 -43.18 99.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.322 0.582 . . . . 0.0 110.189 179.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -57.0 -45.19 83.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.569 0.699 . . . . 0.0 110.032 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 46.8 t -59.58 -38.56 81.52 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.766 177.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -58.63 -45.52 89.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.888 0.375 . . . . 0.0 110.484 -177.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 64.1 mtp85 -59.74 -48.22 82.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.539 -178.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 30.5 mm -58.2 -44.97 88.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.093 0.473 . . . . 0.0 110.044 -178.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 54.3 p -59.51 -44.6 93.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.715 -177.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.51 -43.25 94.17 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.655 -0.978 . . . . 0.0 110.655 -178.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.6 mt -59.07 -49.13 79.06 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.154 0.502 . . . . 0.0 110.552 -178.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 53.2 t -58.54 -43.05 86.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.207 -177.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -58.24 -43.86 88.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.643 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.51 -38.99 96.71 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.461 -0.656 . . . . 0.0 111.461 -179.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 36.8 mt -65.3 -43.98 89.37 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.624 0.249 . . . . 0.0 111.341 179.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 40.8 mt . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.078 -176.564 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 17.0 mt . . . . . 0 C--O 1.233 0.199 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.07 139.79 15.36 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 C-N-CA 121.091 1.194 . . . . 0.0 111.158 174.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -97.14 125.88 44.2 Favored Pre-proline 0 CA--C 1.535 0.394 0 CA-C-O 118.442 -0.79 . . . . 0.0 109.706 179.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -78.1 167.12 23.88 Favored 'Trans proline' 0 N--CA 1.496 1.63 0 CA-C-N 120.607 1.253 . . . . 0.0 111.813 177.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -61.54 156.35 47.64 Favored 'Trans proline' 0 N--CA 1.494 1.551 0 C-N-CA 121.292 1.328 . . . . 0.0 111.218 177.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 23.8 tp -49.95 -30.15 9.82 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -176.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -56.53 -36.72 69.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.762 0.315 . . . . 0.0 111.388 -176.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 5.9 t90 -61.54 -48.19 82.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.851 0.358 . . . . 0.0 110.309 -176.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -64.88 -48.66 73.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.041 0.448 . . . . 0.0 110.863 -178.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 61.8 tt0 -58.56 -43.36 89.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.883 -176.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -59.74 -48.16 82.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.597 -176.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -58.21 -47.59 83.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.135 0.493 . . . . 0.0 110.617 -177.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.295 -176.647 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 16.6 t . . . . . 0 C--O 1.231 0.103 0 CA-C-O 121.078 0.466 . . . . 0.0 110.339 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 45.5 mm -59.54 -41.25 84.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.242 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.8 m -60.05 -45.18 93.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.881 0.372 . . . . 0.0 110.631 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 59.9 ttt85 -59.66 -46.98 87.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.993 0.425 . . . . 0.0 110.459 -178.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 86.1 mtp -58.18 -43.13 87.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.232 0.539 . . . . 0.0 110.375 -178.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -60.53 -48.3 82.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.33 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.4 tp -60.5 -33.63 72.9 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.058 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.47 -50.04 73.02 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.655 0.264 . . . . 0.0 110.608 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.16 -41.36 88.19 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.005 0.431 . . . . 0.0 110.553 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 95.6 mt -54.18 -52.97 32.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.53 178.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -53.28 -25.33 14.27 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -177.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 55.6 mttm -59.72 -32.65 70.73 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -177.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.2 mm -108.86 -42.78 5.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.958 0.409 . . . . 0.0 110.253 -177.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -117.18 77.32 9.37 Favored Pre-proline 0 CA--C 1.535 0.397 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.912 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -55.35 -20.6 26.22 Favored 'Trans proline' 0 N--CA 1.498 1.774 0 C-N-CA 121.481 1.454 . . . . 0.0 113.431 -175.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.4 p90 -90.6 10.23 26.42 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -174.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.74 126.45 32.4 Favored 'General case' 0 C--O 1.231 0.097 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 175.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -97.9 -40.47 8.48 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.799 -0.361 . . . . 0.0 110.778 -176.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -153.05 156.73 39.3 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.549 -0.461 . . . . 0.0 111.565 -179.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 61.8 mt -93.16 138.1 20.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.068 177.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.2 t -90.05 -45.97 15.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.684 176.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -156.74 157.62 35.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.85 178.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.6 p -142.49 132.32 24.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.138 0.494 . . . . 0.0 111.205 -179.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 24.7 t -106.16 124.46 49.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.5 176.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.3 m -54.12 -38.22 65.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.302 -171.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 52.7 t-80 -150.39 126.46 10.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.19 0.519 . . . . 0.0 111.651 -178.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 93.4 t -145.14 138.18 21.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.403 -177.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -126.26 149.84 48.82 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.029 -178.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -98.76 129.99 45.21 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 121.319 0.58 . . . . 0.0 111.682 -176.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -125.43 142.86 51.27 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.461 178.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 90.1 m -121.66 146.61 46.83 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -108.37 131.96 54.22 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.929 0.395 . . . . 0.0 110.395 176.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 31.3 t-20 -104.3 116.13 31.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.91 177.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 86.1 p -68.63 -31.89 71.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.966 -177.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.7 m -61.31 -39.36 90.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.777 0.322 . . . . 0.0 110.909 -177.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -93.7 -21.4 19.37 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 28.1 t30 68.96 42.95 1.22 Allowed 'General case' 0 C--O 1.232 0.134 0 CA-C-O 121.299 0.571 . . . . 0.0 109.8 -177.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -151.54 163.99 37.82 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.106 -177.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 83.0 m95 -94.92 140.92 29.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.322 177.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -122.89 131.34 53.7 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 176.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -76.15 139.79 41.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.278 178.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.3 p -92.32 171.99 8.7 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.699 -0.401 . . . . 0.0 109.944 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -85.81 13.82 6.79 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 178.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.6 t -105.15 106.47 20.57 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 CA-C-O 120.959 0.409 . . . . 0.0 110.464 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -130.34 114.94 16.23 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 175.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.58 176.47 38.91 Favored Glycine 0 CA--C 1.52 0.384 0 C-N-CA 120.065 -1.064 . . . . 0.0 112.372 -169.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -81.64 135.97 35.53 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 175.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -99.55 128.83 45.67 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.127 -176.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -132.08 143.53 50.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.339 177.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 68.9 mt -101.51 128.41 53.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 171.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 14.8 m-30 -108.54 135.56 49.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.007 0.432 . . . . 0.0 111.189 -175.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -115.42 142.48 46.65 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.098 176.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -142.07 146.98 36.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.089 178.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -86.87 28.01 0.94 Allowed 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 178.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.36 165.42 34.77 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -63.89 130.34 94.4 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-O 118.563 -0.732 . . . . 0.0 110.206 -177.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -72.84 140.87 69.42 Favored 'Cis proline' 0 N--CA 1.497 1.694 0 CA-C-N 121.717 1.649 . . . . 0.0 111.331 -3.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -66.45 -43.47 85.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.025 -177.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 69.3 m80 -141.78 136.63 30.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.296 0.569 . . . . 0.0 110.768 -176.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.1 t -151.03 152.25 33.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.476 -178.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 43.9 mt -109.3 140.07 29.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -131.75 141.99 49.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.733 -177.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.4 mt -126.48 130.12 71.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.265 0.555 . . . . 0.0 110.076 173.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -97.81 99.86 11.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 114.946 -1.025 . . . . 0.0 109.776 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -73.27 107.12 5.41 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.802 0.689 . . . . 0.0 110.958 -176.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -71.81 -49.2 40.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.456 -171.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 44.0 mt -67.49 -45.01 77.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.519 -175.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -95.08 -3.0 48.95 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -174.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 11.5 t 44.63 41.39 4.83 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.348 0.594 . . . . 0.0 112.015 178.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 40.1 m -121.25 137.5 54.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.074 -0.967 . . . . 0.0 109.87 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 77.5 p -81.06 132.99 35.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.586 -176.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -119.66 122.16 40.88 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 174.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 38.2 t -125.53 145.81 32.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 120.68 0.276 . . . . 0.0 110.672 -177.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -148.15 126.36 5.96 Favored Pre-proline 0 CA--C 1.538 0.514 0 CA-C-O 118.621 -0.704 . . . . 0.0 110.464 173.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -75.45 150.86 36.87 Favored 'Trans proline' 0 N--CA 1.499 1.838 0 C-N-CA 121.571 1.514 . . . . 0.0 112.316 177.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 67.3 mt -94.25 135.6 28.1 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-O 120.934 0.397 . . . . 0.0 110.077 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.5 p -132.1 157.7 43.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.795 177.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -89.57 32.93 4.55 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.286 -178.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t -111.07 -20.56 12.35 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 173.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.6 mt -68.69 146.49 52.93 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.878 0.37 . . . . 0.0 111.133 -176.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -121.78 135.91 54.93 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.847 176.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 65.5 mt -113.87 159.0 20.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.698 -177.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -148.01 141.51 25.4 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 177.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.9 t -107.12 109.32 21.13 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.92 0.39 . . . . 0.0 111.209 -178.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -106.79 103.63 47.88 Favored Pre-proline 0 CA--C 1.532 0.277 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 170.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -64.03 145.32 89.53 Favored 'Trans proline' 0 N--CA 1.497 1.722 0 CA-C-N 120.523 1.223 . . . . 0.0 111.85 -170.188 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -93.95 18.43 37.95 Favored 'Cis proline' 0 N--CA 1.498 1.779 0 CA-C-N 120.904 1.358 . . . . 0.0 113.183 -3.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -110.59 159.96 17.09 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 110.342 -0.244 . . . . 0.0 110.342 -176.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 31.3 tp -110.76 133.63 53.17 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 122.075 -0.39 . . . . 0.0 111.275 -177.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.2 tp -122.08 140.28 52.71 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.141 -174.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 36.2 p90 -143.16 157.83 44.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.776 0.322 . . . . 0.0 110.467 176.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 31.0 mtm105 -101.85 147.33 26.64 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.893 0.378 . . . . 0.0 110.917 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -128.51 160.8 31.19 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.968 0.889 . . . . 0.0 111.619 -177.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -48.75 148.97 1.91 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.06 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 43.5 mtp180 64.25 30.9 13.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.252 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 47.8 t 67.62 35.24 4.16 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.94 0.4 . . . . 0.0 111.586 165.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -101.89 151.26 22.31 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 74.2 mt -114.1 126.19 71.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -179.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -138.06 150.37 46.84 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -148.51 169.46 29.09 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.043 -175.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -125.15 138.84 54.15 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.992 0.425 . . . . 0.0 110.663 -178.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 44.7 t90 -107.05 125.71 51.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.693 176.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -111.68 144.4 41.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.827 0.346 . . . . 0.0 110.669 -179.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -52.39 -38.03 57.94 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.553 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 -131.48 134.35 46.07 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.761 0.315 . . . . 0.0 110.494 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.8 m -61.87 -42.46 99.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.064 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -59.84 -43.39 94.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.371 0.605 . . . . 0.0 110.061 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -56.68 -44.22 81.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.509 0.671 . . . . 0.0 110.12 178.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 42.6 t -59.92 -40.27 88.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.675 178.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -59.57 -44.53 93.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.777 0.323 . . . . 0.0 110.674 -177.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -59.74 -49.5 77.5 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.011 0.434 . . . . 0.0 110.461 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 30.3 mm -58.3 -45.02 89.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.14 0.495 . . . . 0.0 110.038 -178.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 56.5 p -59.43 -43.51 93.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.733 -177.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.62 -43.9 94.13 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 110.653 -0.979 . . . . 0.0 110.653 -178.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.2 mt -59.12 -49.89 76.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.063 0.458 . . . . 0.0 110.601 -178.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 56.9 t -58.93 -42.81 87.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.129 -178.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -57.77 -43.25 85.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.535 -178.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -60.9 -44.97 97.46 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 111.016 -0.833 . . . . 0.0 111.016 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 61.7 mt -57.77 -42.87 84.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.966 0.413 . . . . 0.0 110.488 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 70.4 mt . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.686 -179.836 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 17.6 mt . . . . . 0 CA--C 1.531 0.223 0 N-CA-C 109.97 -0.381 . . . . 0.0 109.97 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -79.17 139.86 15.24 Favored 'Trans proline' 0 N--CA 1.492 1.393 0 C-N-CA 121.2 1.267 . . . . 0.0 111.201 174.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -97.03 125.7 45.12 Favored Pre-proline 0 CA--C 1.535 0.377 0 CA-C-O 118.8 -0.619 . . . . 0.0 110.022 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -74.15 155.61 47.1 Favored 'Trans proline' 0 N--CA 1.496 1.636 0 C-N-CA 121.488 1.459 . . . . 0.0 111.774 173.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -53.63 154.68 15.37 Favored 'Trans proline' 0 N--CA 1.496 1.625 0 C-N-CA 121.341 1.361 . . . . 0.0 111.561 177.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 6.2 mp -50.42 -29.63 10.63 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -176.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -55.52 -38.58 69.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.865 0.364 . . . . 0.0 111.138 -177.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 8.9 t90 -60.97 -48.08 83.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.136 -177.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -61.29 -49.88 75.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.14 0.495 . . . . 0.0 110.592 -177.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -60.17 -46.21 90.45 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.006 -175.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -58.69 -46.15 87.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.717 -176.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.99 -49.32 77.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.881 -177.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 . . . . . 0 C--N 1.327 -0.396 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.312 -175.173 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.6 m . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.855 0.36 . . . . 0.0 110.737 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.3 mm -60.64 -47.3 93.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.203 -178.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 32.1 m -58.92 -43.67 91.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.531 -177.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -59.62 -45.35 92.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.488 -178.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 66.5 mtt -58.21 -44.35 88.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.117 0.484 . . . . 0.0 110.434 -178.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.9 m120 -60.37 -48.91 79.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.383 -178.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.4 tp -60.76 -32.89 72.18 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.21 -178.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.62 -49.92 73.3 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.638 0.256 . . . . 0.0 110.686 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.87 -41.95 88.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.021 0.439 . . . . 0.0 110.514 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 93.4 mt -54.27 -52.97 33.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.632 178.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -53.84 -20.72 6.23 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -58.29 -34.88 71.02 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 122.266 -0.271 . . . . 0.0 111.589 -178.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.6 mm -112.97 -39.51 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 CA-C-O 120.757 0.313 . . . . 0.0 110.617 -177.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -117.18 77.2 9.29 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.178 -178.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -55.99 -21.09 32.59 Favored 'Trans proline' 0 N--CA 1.497 1.735 0 C-N-CA 121.491 1.461 . . . . 0.0 113.432 -175.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 37.2 p90 -89.11 7.05 37.1 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -174.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -80.61 122.67 27.37 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 174.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.0 ttmm -97.71 -40.4 8.59 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.846 -174.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -149.29 152.53 36.05 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.344 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 41.5 mt -93.27 137.18 23.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.875 177.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.1 t -90.21 -45.99 14.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.704 177.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -156.49 157.08 34.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.908 178.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.8 p -142.39 132.79 25.0 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.996 0.426 . . . . 0.0 111.12 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 14.9 t -107.83 126.35 52.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.663 175.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 88.1 p -54.81 -37.94 66.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.343 -171.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -150.31 125.91 10.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.116 0.484 . . . . 0.0 111.724 -178.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 95.6 t -145.24 143.67 21.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.774 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -131.21 149.48 52.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.866 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -99.22 131.29 45.35 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.261 0.553 . . . . 0.0 111.475 -177.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -124.68 139.71 53.6 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.507 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 72.7 m -119.92 146.8 45.45 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 177.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -106.8 132.03 53.23 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 120.983 0.42 . . . . 0.0 110.381 175.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 30.3 t-20 -104.42 115.79 30.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.947 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.0 m -67.54 -33.01 74.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.899 -177.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.3 p -61.63 -38.57 88.17 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 121.023 -0.271 . . . . 0.0 110.916 -177.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -93.75 -21.42 19.33 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 69.03 42.5 1.26 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.268 0.556 . . . . 0.0 109.825 -177.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -152.27 165.1 35.95 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.144 -177.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -93.88 141.42 28.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.357 177.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -125.03 126.48 45.47 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 176.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -72.86 141.05 47.95 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 177.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 63.3 p -92.19 177.38 6.17 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.254 -178.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -87.09 14.19 8.0 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 45.2 t -109.28 106.37 20.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 120.966 0.412 . . . . 0.0 110.366 179.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -129.91 111.9 13.01 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 173.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.71 176.49 39.01 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 120.192 -1.004 . . . . 0.0 112.176 -168.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.09 135.43 37.71 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 174.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -100.42 128.26 46.53 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 -176.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -131.56 143.04 50.08 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.249 177.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 69.6 mt -101.54 127.78 54.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 172.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 -108.48 137.35 46.58 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.984 0.421 . . . . 0.0 111.298 -175.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 30.5 t60 -117.78 143.25 46.41 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.173 175.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 62.6 ttt180 -142.03 148.37 38.36 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.093 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -86.95 28.15 0.94 Allowed 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.95 164.76 36.52 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -64.01 129.47 93.94 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-O 118.491 -0.766 . . . . 0.0 110.012 -177.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.93 140.87 69.71 Favored 'Cis proline' 0 N--CA 1.497 1.71 0 CA-C-N 121.804 1.68 . . . . 0.0 111.693 -1.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -65.61 -44.72 85.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.007 -177.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -142.79 137.37 29.66 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.442 0.639 . . . . 0.0 110.924 -176.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.4 t -150.61 152.3 33.85 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.326 -177.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 46.1 mt -110.86 138.54 38.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -179.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -131.87 141.93 49.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.066 -176.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.1 mt -123.06 133.25 69.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.218 0.532 . . . . 0.0 109.872 172.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -100.77 99.56 10.11 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.553 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.2 t-20 -71.53 108.58 4.99 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 123.716 0.635 . . . . 0.0 111.023 -175.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -74.82 -38.37 62.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.405 -171.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 67.0 mt -72.9 -45.17 59.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.46 -175.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 49.5 m-20 -95.12 -3.08 48.67 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -175.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.9 p 51.34 42.39 29.07 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.507 0.67 . . . . 0.0 111.03 178.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 40.9 m -127.44 149.07 50.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.812 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 52.7 p -101.86 144.77 30.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.896 0.379 . . . . 0.0 111.292 -177.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -138.6 122.25 17.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.189 177.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.7 p -125.55 148.93 30.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.074 -178.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 48.3 tt0 -147.9 136.61 11.5 Favored Pre-proline 0 CA--C 1.537 0.48 0 CA-C-O 119.059 -0.496 . . . . 0.0 110.597 175.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -75.31 150.89 37.5 Favored 'Trans proline' 0 N--CA 1.497 1.733 0 C-N-CA 121.673 1.582 . . . . 0.0 112.435 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 65.2 mt -90.59 123.69 42.87 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-O 120.935 0.398 . . . . 0.0 110.382 178.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.0 p -99.15 160.88 13.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.003 176.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -98.23 6.03 61.37 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 120.972 -0.632 . . . . 0.0 113.683 -177.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 62.7 m -100.34 -0.96 37.33 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.035 0.917 . . . . 0.0 113.034 177.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.1 mt -69.23 139.92 54.5 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-N 118.105 0.412 . . . . 0.0 111.411 -177.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.7 tt0 -111.43 135.82 51.45 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.539 174.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 74.4 mt -112.99 156.91 22.22 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.149 0.499 . . . . 0.0 111.371 -175.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -142.09 140.0 32.4 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.7 t -104.83 109.1 20.92 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.982 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -106.94 103.69 48.59 Favored Pre-proline 0 C--N 1.329 -0.297 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 170.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.1 141.49 48.06 Favored 'Trans proline' 0 N--CA 1.497 1.685 0 CA-C-N 120.627 1.26 . . . . 0.0 111.833 -172.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -90.54 11.74 57.89 Favored 'Cis proline' 0 N--CA 1.498 1.773 0 CA-C-N 121.154 1.448 . . . . 0.0 113.699 -3.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -91.3 170.7 9.77 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.544 0.211 . . . . 0.0 110.806 -177.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 47.4 tp -120.8 135.96 55.02 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 173.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.3 tp -127.14 140.02 52.55 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -175.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -143.77 155.91 44.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.878 0.371 . . . . 0.0 110.602 175.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 27.5 mtm105 -101.9 146.62 27.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.723 -178.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -128.07 163.75 23.91 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.722 0.772 . . . . 0.0 111.385 -177.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -47.31 146.17 2.06 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.227 -177.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 25.1 mmt85 65.12 30.9 11.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.173 -0.922 . . . . 0.0 112.136 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.6 m 66.36 35.17 5.9 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.898 0.38 . . . . 0.0 111.616 166.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -99.35 150.06 22.52 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 77.8 mt -114.47 127.76 71.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 121.076 0.465 . . . . 0.0 109.774 -178.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 90.3 mtt180 -137.24 145.91 44.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.412 178.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.85 169.35 25.29 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -125.29 138.77 54.09 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.783 0.325 . . . . 0.0 110.909 -178.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 77.8 t90 -104.09 126.74 51.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.517 175.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -115.6 141.37 48.16 Favored 'General case' 0 C--N 1.33 -0.276 0 O-C-N 123.244 0.34 . . . . 0.0 110.563 -179.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -50.68 -37.96 44.08 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.785 178.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -133.52 137.29 45.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.305 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.2 t -62.21 -42.36 99.22 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.127 -178.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -59.32 -44.29 92.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.425 0.631 . . . . 0.0 110.043 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -56.78 -44.05 81.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.088 178.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 51.8 t -58.93 -39.01 80.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.551 177.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -59.09 -46.19 88.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.8 0.333 . . . . 0.0 110.566 -177.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.9 mtm105 -61.4 -49.92 74.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.745 -177.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 28.1 mm -58.54 -43.88 88.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.033 0.444 . . . . 0.0 109.955 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 57.3 p -59.81 -44.25 94.1 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.674 -177.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.54 -43.91 93.99 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 -178.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.5 mt -58.8 -48.67 80.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.142 0.496 . . . . 0.0 110.508 -178.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 54.7 t -59.0 -42.85 87.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.146 -178.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -57.36 -42.66 82.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.915 0.388 . . . . 0.0 110.566 -178.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.68 -43.54 99.12 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.243 -0.743 . . . . 0.0 111.243 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.7 mt -60.76 -42.2 96.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.801 0.334 . . . . 0.0 110.832 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 81.0 mt . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.139 -177.928 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 14.6 mt . . . . . 0 CA--C 1.53 0.203 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -79.14 139.7 15.18 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 C-N-CA 121.177 1.252 . . . . 0.0 111.366 174.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -97.17 125.94 43.95 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-O 118.463 -0.78 . . . . 0.0 109.628 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo -78.1 161.58 29.4 Favored 'Trans proline' 0 N--CA 1.496 1.656 0 C-N-CA 121.187 1.258 . . . . 0.0 111.929 178.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -49.91 157.0 2.94 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 C-N-CA 121.345 1.363 . . . . 0.0 111.838 177.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 81.2 mt -49.98 -23.56 2.08 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -177.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -58.33 -36.34 73.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.702 0.286 . . . . 0.0 111.497 -176.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 49.1 t90 -65.06 -48.4 73.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.685 -0.234 . . . . 0.0 111.061 -173.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -70.84 -40.13 72.56 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.881 -176.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -61.05 -46.27 91.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.858 0.361 . . . . 0.0 110.578 -179.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -59.83 -47.75 84.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.616 -176.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.07 -47.79 83.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.981 0.419 . . . . 0.0 110.773 -177.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.319 -175.307 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.5 m . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.876 0.37 . . . . 0.0 110.571 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.9 mm -60.34 -45.11 96.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.133 -178.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.3 m -59.21 -44.75 92.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.924 0.392 . . . . 0.0 110.561 -177.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -60.12 -45.64 92.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.482 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 66.2 mtt -58.13 -42.43 85.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.992 0.425 . . . . 0.0 110.457 -178.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -60.93 -50.52 73.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.251 -178.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 13.1 tp -59.84 -30.34 68.88 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.794 -0.363 . . . . 0.0 111.32 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.3 -51.99 60.72 Favored 'General case' 0 C--N 1.332 -0.153 0 O-C-N 122.161 -0.337 . . . . 0.0 110.754 178.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.65 -40.83 80.17 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.027 0.441 . . . . 0.0 110.553 179.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 93.9 mt -54.12 -53.01 31.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.608 178.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -51.9 -25.19 7.52 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -178.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -59.26 -34.37 72.16 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -177.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.5 mm -106.53 -44.79 7.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.112 0.482 . . . . 0.0 109.938 -177.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -117.2 77.49 9.57 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.628 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -55.05 -20.66 24.3 Favored 'Trans proline' 0 N--CA 1.497 1.704 0 C-N-CA 121.491 1.461 . . . . 0.0 113.631 -174.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.3 p90 -89.03 2.06 54.61 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -174.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -78.59 130.23 35.69 Favored 'General case' 0 C--O 1.231 0.093 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 175.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -108.84 -39.25 5.39 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.025 -174.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.3 tt0 -131.63 146.03 51.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.995 0.426 . . . . 0.0 111.137 -175.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 58.7 mt -100.54 132.07 46.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.681 172.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.1 t -91.59 -47.12 14.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.098 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -157.22 157.51 34.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.953 178.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 64.2 p -143.64 132.24 22.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.119 0.485 . . . . 0.0 111.234 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.6 t -107.05 126.59 52.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.551 176.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.6 m -54.54 -38.87 67.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.313 -172.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -149.81 126.6 11.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.119 0.485 . . . . 0.0 111.68 -178.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 93.8 t -145.22 140.53 22.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.09 -0.959 . . . . 0.0 109.531 -177.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.56 149.84 51.15 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.684 0.278 . . . . 0.0 111.203 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -98.5 131.03 45.07 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.365 0.602 . . . . 0.0 111.798 -176.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -127.5 140.41 52.16 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.199 177.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.3 m -121.66 145.49 47.95 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -109.15 131.0 55.48 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.913 0.387 . . . . 0.0 110.344 177.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -101.94 115.21 30.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.835 176.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 85.4 p -68.71 -31.35 70.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.998 -0.547 . . . . 0.0 112.015 -177.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.1 m -62.44 -37.81 87.32 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.652 0.263 . . . . 0.0 111.076 -178.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -95.59 -21.45 18.23 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -178.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 54.8 t30 69.4 46.08 0.79 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.524 0.678 . . . . 0.0 109.425 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 74.5 tt0 -155.06 151.46 28.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.058 -177.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 85.6 m95 -88.18 141.85 28.23 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.307 176.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -121.93 129.01 52.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.881 176.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -74.53 136.92 42.15 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 178.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 71.5 p -92.3 169.88 10.24 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.188 -178.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.4 p-10 -83.12 11.13 6.78 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.8 t -101.62 106.47 19.7 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-O 120.934 0.397 . . . . 0.0 110.287 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -131.51 111.37 11.71 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 175.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.63 176.57 38.94 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.015 -1.088 . . . . 0.0 112.307 -168.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -80.6 134.9 35.97 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 174.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -99.21 128.37 45.33 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 -176.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -132.52 143.05 49.48 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.341 177.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 68.9 mt -101.59 127.71 54.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 172.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 15.3 m-30 -108.44 138.29 44.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.845 0.355 . . . . 0.0 111.608 -176.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 64.1 t60 -114.66 143.37 45.14 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.283 174.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 29.3 ttp180 -141.46 152.35 44.15 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.481 177.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -86.95 28.19 0.93 Allowed 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.844 -0.617 . . . . 0.0 112.14 -178.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -155.45 152.15 28.64 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -63.98 133.51 95.61 Favored Pre-proline 0 CA--C 1.541 0.598 0 CA-C-O 118.456 -0.783 . . . . 0.0 110.323 -176.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -68.29 140.85 57.98 Favored 'Cis proline' 0 N--CA 1.498 1.746 0 CA-C-N 121.672 1.633 . . . . 0.0 111.409 -0.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -66.61 -38.78 87.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.253 -176.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -141.44 141.11 33.72 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.683 0.754 . . . . 0.0 111.122 -176.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.6 t -149.8 151.31 33.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.912 -178.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 50.4 mt -109.82 140.46 28.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -131.79 142.11 49.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.578 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 58.9 mt -123.49 128.62 74.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.186 0.517 . . . . 0.0 109.894 172.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -94.07 99.54 11.82 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.171 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -75.45 106.85 7.2 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.65 0.594 . . . . 0.0 111.045 -174.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -72.45 -43.49 63.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.565 -171.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 67.3 mt -70.8 -45.17 65.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.731 -174.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 37.2 m-20 -95.09 -3.29 48.38 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -175.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.3 p 50.35 42.29 25.76 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.511 0.672 . . . . 0.0 111.257 177.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.5 m -127.16 145.93 50.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.232 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 97.5 p -88.24 132.64 34.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.248 -178.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -123.07 122.26 38.05 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 174.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.3 t -125.42 148.0 30.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 120.764 0.316 . . . . 0.0 110.946 -175.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -148.73 126.48 5.73 Favored Pre-proline 0 CA--C 1.539 0.552 0 CA-C-O 118.678 -0.677 . . . . 0.0 110.495 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -75.49 151.0 36.87 Favored 'Trans proline' 0 N--CA 1.499 1.836 0 C-N-CA 121.408 1.405 . . . . 0.0 112.05 177.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 70.3 mt -91.44 112.29 25.18 Favored 'Isoleucine or valine' 0 C--O 1.231 0.125 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.472 179.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 66.0 p -98.94 153.34 18.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.842 175.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -96.59 32.5 6.47 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.355 -178.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.0 m -111.05 -19.13 12.86 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 173.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.9 mt -68.81 145.69 53.53 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.914 0.388 . . . . 0.0 111.452 -175.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 54.8 tt0 -111.76 136.12 51.46 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.819 175.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 64.2 mt -110.97 158.64 18.55 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.709 -177.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -149.52 142.95 25.3 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.1 t -100.38 109.18 21.34 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.476 179.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 23.7 mm-40 -106.61 103.67 47.52 Favored Pre-proline 0 C--N 1.329 -0.296 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 173.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -67.5 141.15 54.64 Favored 'Trans proline' 0 N--CA 1.497 1.724 0 CA-C-N 120.512 1.219 . . . . 0.0 111.919 -171.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -90.6 11.14 59.37 Favored 'Cis proline' 0 N--CA 1.499 1.818 0 CA-C-N 121.173 1.455 . . . . 0.0 113.667 -5.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -92.3 170.33 9.88 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.516 0.326 . . . . 0.0 110.67 -176.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 56.2 tp -115.59 134.48 55.02 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 173.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 12.0 tp -127.58 140.23 52.25 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 -173.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -148.17 155.52 41.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.849 0.357 . . . . 0.0 110.477 175.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.2 mtm105 -104.71 147.97 27.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.947 -176.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -128.67 167.34 17.36 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.944 0.878 . . . . 0.0 111.339 -178.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -47.77 148.48 1.55 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.195 -0.912 . . . . 0.0 112.188 -177.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 62.82 30.96 16.65 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.134 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.2 p 65.34 35.33 7.61 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.758 0.313 . . . . 0.0 111.638 166.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 68.5 mtp180 -98.0 147.21 24.73 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 76.9 mt -111.65 127.05 69.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 -177.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -134.26 147.96 50.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.451 -179.117 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.39 166.43 26.81 Favored Glycine 0 CA--C 1.524 0.652 0 C-N-CA 120.901 -0.666 . . . . 0.0 111.621 -178.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -125.27 140.78 52.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.24 -0.48 . . . . 0.0 110.213 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 83.9 t90 -107.42 128.98 54.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.652 175.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -115.46 144.24 44.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.806 0.336 . . . . 0.0 110.76 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -52.1 -35.92 49.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.568 177.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -135.44 135.69 40.75 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.814 0.34 . . . . 0.0 110.487 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.7 t -62.58 -42.32 99.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.188 -177.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -59.44 -43.88 93.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.412 0.625 . . . . 0.0 110.099 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -56.42 -45.55 80.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.077 179.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 41.3 t -60.47 -38.59 84.71 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.858 178.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -59.14 -45.57 90.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.829 0.347 . . . . 0.0 110.488 -177.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 -60.58 -48.52 81.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.574 -178.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 28.5 mm -58.24 -44.94 89.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.044 0.45 . . . . 0.0 109.982 -178.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 57.8 p -59.35 -44.01 92.73 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.692 -177.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.62 -43.96 94.11 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.7 mt -58.74 -48.6 80.62 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.136 0.493 . . . . 0.0 110.502 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 48.9 t -58.73 -44.12 89.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.141 -178.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 31.3 m120 -58.51 -41.9 86.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.828 -178.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.58 -42.94 99.64 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 111.411 -0.676 . . . . 0.0 111.411 -178.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 47.5 mt -63.29 -43.0 99.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.801 0.334 . . . . 0.0 111.172 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 25.4 mt . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.591 -176.884 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 26.6 mt . . . . . 0 CA--C 1.532 0.256 0 CA-C-O 118.425 -0.797 . . . . 0.0 109.736 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -79.14 139.61 15.12 Favored 'Trans proline' 0 N--CA 1.494 1.532 0 CA-C-N 120.401 1.179 . . . . 0.0 111.16 174.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 26.3 mtmt -97.26 125.97 43.63 Favored Pre-proline 0 CA--C 1.535 0.384 0 CA-C-O 118.462 -0.78 . . . . 0.0 110.35 178.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -63.64 162.33 28.48 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 CA-C-N 120.697 1.284 . . . . 0.0 111.515 176.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -49.82 156.68 3.09 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 121.316 1.344 . . . . 0.0 111.739 178.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 82.0 mt -50.04 -28.81 7.6 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -176.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 64.0 t80 -55.69 -37.56 68.51 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.814 0.34 . . . . 0.0 111.205 -177.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 52.9 t90 -60.96 -48.13 83.26 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.425 -176.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -63.64 -48.89 75.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.035 0.445 . . . . 0.0 110.618 -178.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.29 -42.42 91.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.017 -176.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -59.37 -49.39 77.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.88 0.371 . . . . 0.0 110.592 -176.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.21 -49.44 77.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.771 -177.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.331 -175.742 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.8 m . . . . . 0 CA--C 1.526 0.044 0 CA-C-O 120.932 0.396 . . . . 0.0 110.809 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.3 mm -60.67 -47.72 91.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.13 -178.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.7 m -58.45 -43.43 88.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.466 -177.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -60.02 -45.76 91.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.644 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 89.7 mtp -58.21 -43.06 87.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.04 0.448 . . . . 0.0 110.448 -178.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -60.69 -50.16 74.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.298 -178.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.1 tp -60.66 -30.77 70.1 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.276 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.15 -50.7 69.38 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 122.276 -0.265 . . . . 0.0 110.601 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.97 -41.67 83.43 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.001 0.429 . . . . 0.0 110.424 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 94.4 mt -54.23 -52.94 33.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.594 178.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -53.95 -24.38 16.3 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -59.25 -33.22 70.76 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.0 mm -107.9 -42.09 5.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.765 0.317 . . . . 0.0 110.298 -177.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 35.9 t0 -115.11 85.47 12.42 Favored Pre-proline 0 CA--C 1.533 0.323 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.709 -175.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -53.75 -24.4 30.28 Favored 'Trans proline' 0 N--CA 1.497 1.709 0 C-N-CA 121.421 1.414 . . . . 0.0 113.319 -177.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.6 p90 -95.5 19.56 10.81 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 -175.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -101.94 118.21 36.43 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 172.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -112.98 -33.51 6.03 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -173.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -127.91 142.47 51.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.842 0.354 . . . . 0.0 110.684 -178.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 57.8 mt -99.43 129.78 49.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.827 173.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.9 t -90.57 -47.23 14.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.268 -0.423 . . . . 0.0 109.943 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -154.37 154.42 33.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.991 178.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 58.7 p -142.29 131.95 24.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.045 0.45 . . . . 0.0 111.009 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 38.5 t -107.58 126.61 52.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.682 177.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 86.7 p -54.59 -38.05 66.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.232 -172.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 61.0 t-80 -151.15 126.06 9.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.256 0.55 . . . . 0.0 111.523 -179.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 99.6 t -144.86 142.18 23.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.44 -178.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -130.53 149.76 52.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.09 -178.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -97.12 131.02 44.3 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.275 0.559 . . . . 0.0 111.588 -177.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -124.42 141.18 52.28 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.585 178.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 92.2 m -122.34 145.08 48.59 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 177.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -108.03 130.45 55.07 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 120.893 0.378 . . . . 0.0 110.313 177.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -101.29 114.86 29.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.784 176.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 27.1 m -67.49 -32.94 74.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.842 -177.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.0 m -61.47 -38.41 87.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.635 0.255 . . . . 0.0 111.006 -177.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -94.58 -21.5 18.8 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -178.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 25.8 t30 68.81 45.53 0.99 Allowed 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.426 0.631 . . . . 0.0 109.438 -177.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 78.2 tt0 -154.05 150.95 28.76 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.083 -176.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 89.4 m95 -86.51 142.02 28.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.255 176.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -125.04 134.09 52.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.34 -0.391 . . . . 0.0 109.99 176.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -75.53 140.95 43.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.287 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 62.6 p -92.39 172.36 8.44 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.066 178.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -83.86 12.61 5.84 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.9 t -108.41 106.49 20.79 Favored 'Isoleucine or valine' 0 C--O 1.231 0.123 0 CA-C-O 121.067 0.46 . . . . 0.0 110.43 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -129.96 112.63 13.69 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 173.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.61 176.49 38.93 Favored Glycine 0 CA--C 1.52 0.391 0 C-N-CA 120.192 -1.004 . . . . 0.0 112.354 -168.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.75 134.79 37.02 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 175.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -100.04 126.9 46.31 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.146 -175.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -131.52 142.16 49.89 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.767 0.318 . . . . 0.0 110.537 177.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 67.7 mt -101.68 126.72 55.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 172.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 14.0 m-30 -108.46 137.69 46.01 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.826 0.346 . . . . 0.0 111.343 -176.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 58.1 t60 -114.11 143.29 45.03 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.368 175.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.8 tpt180 -142.09 147.53 36.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.427 175.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.8 m120 -86.79 28.17 0.92 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.25 171.32 20.41 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -63.98 124.75 86.2 Favored Pre-proline 0 CA--C 1.539 0.535 0 CA-C-O 118.439 -0.791 . . . . 0.0 110.021 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -78.73 140.93 61.65 Favored 'Cis proline' 0 N--CA 1.498 1.746 0 CA-C-N 121.994 1.748 . . . . 0.0 111.906 -0.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -63.83 -46.53 84.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.096 -177.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -143.15 138.66 29.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.341 0.591 . . . . 0.0 110.992 -176.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.6 t -150.18 152.06 34.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.37 -178.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 50.8 mt -114.48 137.14 48.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 -178.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -131.91 142.19 49.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.537 -176.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 62.2 mt -120.4 129.93 75.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.2 0.524 . . . . 0.0 109.706 172.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -96.13 99.55 11.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.981 -1.009 . . . . 0.0 109.322 179.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.3 t-20 -71.79 106.28 4.09 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 123.669 0.605 . . . . 0.0 111.062 -174.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -74.01 -40.07 63.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.252 -171.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 72.9 mt -72.05 -45.19 61.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.648 -174.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 60.9 m-20 -95.11 -3.32 48.25 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 -175.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.3 m 55.6 43.18 28.66 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-O 121.493 0.663 . . . . 0.0 110.561 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.6 m -127.52 148.9 50.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.56 -177.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.9 p -99.2 135.36 40.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.322 -179.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -131.91 122.23 25.3 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.673 0.273 . . . . 0.0 110.266 175.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.7 p -125.54 149.88 30.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.094 -177.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 26.4 tp10 -147.36 133.95 9.88 Favored Pre-proline 0 CA--C 1.538 0.509 0 CA-C-O 118.861 -0.59 . . . . 0.0 110.302 174.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.42 150.94 37.1 Favored 'Trans proline' 0 N--CA 1.498 1.765 0 C-N-CA 121.54 1.494 . . . . 0.0 112.301 179.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 63.7 mt -89.47 139.5 17.36 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.19 177.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.1 p -132.09 156.88 45.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.867 177.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -98.16 37.71 3.37 Favored Glycine 0 CA--C 1.524 0.6 0 C-N-CA 121.0 -0.619 . . . . 0.0 111.832 -178.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 51.6 p -111.07 -23.19 11.06 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 174.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.8 mt -69.09 145.82 53.1 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.977 0.418 . . . . 0.0 111.502 -175.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 57.0 tt0 -113.66 135.92 53.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.556 175.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 68.9 mt -111.12 160.0 17.31 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.99 0.424 . . . . 0.0 110.978 -175.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -149.52 140.76 23.12 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.219 -0.659 . . . . 0.0 109.219 178.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.5 t -99.12 109.19 21.93 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.871 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -106.8 103.81 48.7 Favored Pre-proline 0 C--N 1.329 -0.307 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 172.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -71.67 139.87 34.77 Favored 'Trans proline' 0 N--CA 1.497 1.708 0 CA-C-N 120.501 1.215 . . . . 0.0 112.047 -171.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -88.99 9.49 64.49 Favored 'Cis proline' 0 N--CA 1.501 1.926 0 CA-C-N 121.22 1.471 . . . . 0.0 113.684 -4.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -84.61 170.41 13.4 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.775 0.321 . . . . 0.0 110.986 -177.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.1 tp -118.84 133.34 55.9 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 170.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.9 tp -126.01 141.01 52.14 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.538 0.209 . . . . 0.0 110.499 -174.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 15.3 p90 -147.4 156.37 42.82 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.799 0.333 . . . . 0.0 110.382 176.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.7 mtm105 -101.93 144.24 30.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.97 0.414 . . . . 0.0 110.734 -178.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -124.95 162.84 23.59 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.738 0.78 . . . . 0.0 111.446 -176.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -47.75 146.21 2.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.164 -177.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 65.36 30.92 10.81 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.067 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 43.1 t 66.17 35.19 6.24 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.863 0.363 . . . . 0.0 111.7 164.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.9 mtt-85 -102.93 152.76 20.94 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 81.4 mt -111.99 127.75 68.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-O 121.075 0.464 . . . . 0.0 109.813 -176.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 80.4 mtt180 -130.25 147.13 51.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.463 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -142.61 166.29 26.56 Favored Glycine 0 CA--C 1.523 0.537 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 -178.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -126.05 140.84 52.27 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.742 0.306 . . . . 0.0 110.749 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 13.5 t90 -108.5 128.27 54.65 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.608 175.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -117.54 144.22 45.32 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.769 0.319 . . . . 0.0 110.631 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -52.4 -36.79 54.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.582 178.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 39.1 t-20 -134.01 135.05 43.15 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.757 0.313 . . . . 0.0 110.511 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.3 p -61.92 -41.39 97.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.172 -177.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -60.69 -43.18 98.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.421 0.629 . . . . 0.0 110.159 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -56.53 -45.31 81.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.579 0.704 . . . . 0.0 109.99 178.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 42.1 t -60.01 -39.27 85.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.705 178.02 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -58.72 -44.91 90.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.907 0.384 . . . . 0.0 110.545 -177.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -60.25 -48.77 80.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.593 -177.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 31.0 mm -58.51 -45.45 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.064 0.459 . . . . 0.0 109.979 -178.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.5 p -59.7 -43.78 93.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.733 -177.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.72 -43.79 94.36 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 -178.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 10.3 mt -59.15 -48.92 79.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.054 0.454 . . . . 0.0 110.616 -178.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 58.7 t -59.21 -43.13 88.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.056 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 27.3 m120 -57.54 -42.55 83.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.6 -178.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.79 -45.44 96.21 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 -179.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 27.4 mt -58.56 -42.21 87.4 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.876 0.37 . . . . 0.0 110.594 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 80.6 mt . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.638 179.27 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 12.0 mt . . . . . 0 CA--C 1.531 0.231 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.1 139.74 15.28 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 C-N-CA 121.09 1.193 . . . . 0.0 111.257 175.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 12.1 mmmt -97.13 125.74 44.74 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-O 118.783 -0.627 . . . . 0.0 110.011 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -74.2 155.22 46.91 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 121.396 1.397 . . . . 0.0 111.565 172.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -50.66 157.02 3.83 Favored 'Trans proline' 0 N--CA 1.495 1.569 0 C-N-CA 121.236 1.291 . . . . 0.0 111.721 178.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 82.4 mt -50.04 -26.93 4.84 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 57.1 t80 -55.15 -38.13 67.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.892 0.377 . . . . 0.0 111.086 -177.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 46.3 t90 -61.12 -48.04 83.49 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.298 -177.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -60.07 -46.87 88.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.97 0.414 . . . . 0.0 110.421 -177.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -60.41 -43.75 96.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.955 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -59.14 -45.59 90.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.773 -177.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -62.59 -52.91 61.54 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.858 -176.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 19.0 pt20 . . . . . 0 C--N 1.327 -0.375 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.482 -176.082 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.8 t . . . . . 0 C--O 1.23 0.029 0 CA-C-O 121.043 0.449 . . . . 0.0 110.507 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.4 mm -59.69 -44.53 93.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.18 -178.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.3 m -59.48 -44.97 92.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.449 -177.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -59.55 -45.27 92.31 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.52 -178.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 88.5 mtp -58.22 -43.68 87.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.02 0.438 . . . . 0.0 110.421 -178.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -60.32 -49.22 78.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.269 -178.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.7 tp -59.16 -33.85 71.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.972 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.37 -50.54 69.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.546 0.212 . . . . 0.0 110.875 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.01 -42.13 84.57 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.976 0.417 . . . . 0.0 110.441 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 94.8 mt -54.22 -52.92 33.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.7 178.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -51.54 -25.13 6.15 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -178.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.5 tptp -57.84 -35.52 71.02 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.603 0.24 . . . . 0.0 111.469 -178.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.3 mm -103.92 -47.88 10.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.119 0.485 . . . . 0.0 109.792 -178.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -117.57 79.18 12.16 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.043 -176.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -54.72 -20.59 22.31 Favored 'Trans proline' 0 N--CA 1.498 1.746 0 C-N-CA 121.545 1.497 . . . . 0.0 113.695 -175.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 19.5 p90 -90.41 5.45 47.45 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -174.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -80.72 125.12 29.65 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 173.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 79.7 tttt -104.59 -39.51 6.35 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.814 -0.354 . . . . 0.0 111.124 -172.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -134.41 146.33 49.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.956 0.408 . . . . 0.0 111.27 -175.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 21.1 mt -100.87 133.65 43.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 172.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.7 t -92.39 -47.19 14.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.936 179.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -152.07 154.18 35.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.068 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.4 p -141.82 132.02 24.87 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.01 0.433 . . . . 0.0 110.748 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.7 t -107.4 128.98 54.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.737 176.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 87.3 p -54.58 -37.87 66.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.302 -172.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -152.74 127.34 9.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.231 0.539 . . . . 0.0 111.702 -178.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 97.5 t -145.27 141.82 22.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 114.97 -1.014 . . . . 0.0 109.521 -177.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.92 149.9 51.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.041 -178.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -100.72 131.64 46.51 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.278 0.561 . . . . 0.0 111.597 -177.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -126.5 144.73 50.77 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.826 179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 84.2 m -122.71 147.94 45.89 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 177.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -108.84 132.0 54.44 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.983 0.421 . . . . 0.0 110.379 176.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.9 t-20 -104.1 114.76 29.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.779 177.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.9 m -67.7 -32.71 73.54 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.969 -176.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.0 t -60.37 -39.71 88.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.757 0.313 . . . . 0.0 110.904 -177.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -94.09 -21.41 19.14 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 69.37 43.97 0.99 Allowed 'General case' 0 C--O 1.232 0.139 0 CA-C-O 121.419 0.628 . . . . 0.0 109.703 -177.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -150.02 163.46 38.08 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.165 -177.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -96.43 139.77 32.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.25 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -123.69 130.28 52.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.083 176.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -75.27 142.48 43.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.0 178.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.9 p -92.33 177.21 6.21 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.719 -0.393 . . . . 0.0 110.07 179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -86.93 13.6 8.79 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.4 t -109.48 106.39 20.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 120.928 0.394 . . . . 0.0 110.619 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -129.95 111.55 12.65 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 173.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.64 176.51 38.95 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 120.261 -0.971 . . . . 0.0 112.256 -168.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.53 136.72 37.63 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 175.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -101.64 126.16 48.43 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.27 -175.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -129.88 142.25 50.69 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.817 0.341 . . . . 0.0 110.402 177.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 67.5 mt -101.61 127.02 55.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 172.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 16.1 m-30 -108.55 139.66 43.01 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.929 0.395 . . . . 0.0 111.516 -176.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -113.13 143.34 44.52 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.014 174.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 30.0 ttp180 -141.13 152.86 45.06 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.59 178.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -86.89 28.11 0.93 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.164 -178.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -155.3 152.35 29.1 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -63.98 133.78 95.71 Favored Pre-proline 0 CA--C 1.541 0.598 0 CA-C-O 118.49 -0.767 . . . . 0.0 110.252 -176.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -68.35 140.91 58.55 Favored 'Cis proline' 0 N--CA 1.499 1.797 0 CA-C-N 121.702 1.644 . . . . 0.0 111.437 -1.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -63.64 -38.72 92.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.189 -177.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -141.06 141.85 34.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.611 0.719 . . . . 0.0 111.086 -176.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.2 t -149.54 152.16 35.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.922 -178.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 54.0 mt -113.03 138.66 41.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 -177.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -131.79 142.09 49.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.146 -177.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.1 mt -121.11 130.55 74.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-O 121.275 0.559 . . . . 0.0 109.815 172.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -96.44 99.58 11.23 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.269 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.7 t-20 -72.16 107.12 4.66 Favored 'General case' 0 C--N 1.332 -0.176 0 O-C-N 123.58 0.55 . . . . 0.0 111.192 -174.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.6 mtm105 -74.51 -39.8 62.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.387 -171.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 56.7 mt -74.2 -45.17 50.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.475 -175.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 39.4 t-20 -95.05 -3.23 48.63 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -175.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 63.3 p 51.52 42.54 29.53 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.479 0.656 . . . . 0.0 110.959 178.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.6 m -124.37 148.92 47.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.201 -179.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 11.2 p -98.97 134.7 41.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.281 -178.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -131.39 122.15 25.83 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.33 175.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.5 p -125.58 149.76 30.49 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.008 -178.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -149.04 132.13 8.18 Favored Pre-proline 0 CA--C 1.538 0.511 0 CA-C-O 118.834 -0.603 . . . . 0.0 110.493 175.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.45 150.92 36.96 Favored 'Trans proline' 0 N--CA 1.499 1.816 0 C-N-CA 121.552 1.501 . . . . 0.0 112.276 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 66.1 mt -90.81 123.39 42.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.143 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.393 178.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 80.6 p -98.79 163.27 12.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.993 176.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -97.82 15.88 61.13 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 120.861 -0.685 . . . . 0.0 113.265 -178.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 40.7 p -111.0 2.1 17.82 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 117.746 0.773 . . . . 0.0 112.956 176.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.3 mt -69.49 141.07 54.01 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 118.077 0.399 . . . . 0.0 111.192 -177.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -113.99 135.8 53.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.739 175.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 67.2 mt -119.38 158.34 26.35 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.986 0.422 . . . . 0.0 111.121 -175.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -149.68 141.53 23.73 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 176.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.0 t -105.69 109.17 21.04 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.196 -178.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -106.77 103.66 47.98 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 118.306 -0.854 . . . . 0.0 108.757 170.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.73 143.75 62.95 Favored 'Trans proline' 0 N--CA 1.499 1.81 0 CA-C-N 120.6 1.25 . . . . 0.0 111.955 -171.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -90.72 14.46 50.44 Favored 'Cis proline' 0 N--CA 1.501 1.916 0 CA-C-N 121.016 1.398 . . . . 0.0 113.518 -3.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -94.55 161.87 14.03 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 122.36 0.264 . . . . 0.0 110.411 -178.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 46.9 tp -114.93 132.89 56.4 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 172.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.6 tp -122.73 139.42 53.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.282 -173.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 48.7 p90 -142.93 154.62 44.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.826 0.346 . . . . 0.0 110.488 175.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.2 mtm180 -101.78 145.76 28.71 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.7 -178.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -127.68 164.77 21.35 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.659 0.743 . . . . 0.0 111.534 -176.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -47.2 145.62 2.2 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.171 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 12.4 tpt180 65.28 30.91 10.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.322 -0.854 . . . . 0.0 112.019 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.0 t 64.93 35.27 8.41 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.896 0.379 . . . . 0.0 111.527 166.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 50.6 mtm180 -98.25 150.63 21.32 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 179.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 74.2 mt -114.66 127.53 72.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 -178.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -140.14 150.39 44.19 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.612 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.7 169.32 26.08 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 120.965 -0.636 . . . . 0.0 111.634 -175.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -125.22 137.3 54.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.389 -0.405 . . . . 0.0 110.4 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 42.7 t90 -107.18 127.53 53.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.6 176.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -114.54 146.15 41.09 Favored 'General case' 0 C--N 1.329 -0.294 0 O-C-N 123.223 0.327 . . . . 0.0 110.509 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -51.57 -36.35 44.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.627 177.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -134.08 134.85 42.79 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.416 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.7 t -61.2 -41.81 97.48 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.988 -177.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -59.88 -43.02 94.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.359 0.599 . . . . 0.0 110.176 179.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -56.98 -44.54 82.76 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.937 178.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 43.3 t -59.98 -38.71 83.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.698 177.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -59.1 -46.05 89.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.876 0.369 . . . . 0.0 110.502 -177.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 60.6 ttm-85 -59.79 -48.71 80.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.053 0.454 . . . . 0.0 110.579 -178.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 30.1 mm -58.33 -44.56 88.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.052 -179.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 53.3 p -59.4 -44.2 92.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.649 -177.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.78 -44.59 94.14 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 -178.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 10.4 mt -58.73 -48.34 81.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.114 0.483 . . . . 0.0 110.553 -178.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 50.6 t -58.9 -43.41 88.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.078 -178.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -57.4 -42.43 82.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.636 -178.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.33 -45.3 96.73 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.954 -0.858 . . . . 0.0 110.954 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.6 mt -57.82 -42.69 84.79 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.93 0.395 . . . . 0.0 110.524 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 86.9 mt . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.636 179.869 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 16.8 mt . . . . . 0 C--O 1.232 0.168 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -79.03 139.86 15.47 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 C-N-CA 121.227 1.285 . . . . 0.0 110.841 173.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -95.66 125.72 48.13 Favored Pre-proline 0 CA--C 1.534 0.354 0 CA-C-O 118.803 -0.618 . . . . 0.0 109.667 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -77.95 154.03 29.43 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 121.446 1.431 . . . . 0.0 111.643 173.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -58.47 154.2 43.27 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 121.313 1.342 . . . . 0.0 111.404 177.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 6.2 mp -50.66 -30.5 13.73 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -176.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -55.88 -38.04 69.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.82 0.343 . . . . 0.0 111.188 -177.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 7.6 t90 -61.92 -48.06 82.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.151 -177.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -60.4 -47.06 87.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.113 0.483 . . . . 0.0 110.519 -177.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -59.93 -45.38 92.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.794 -177.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -57.81 -45.15 86.53 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.539 -177.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.21 -48.26 82.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.577 -178.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.951 -177.223 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 24.8 m . . . . . 0 CA--C 1.526 0.038 0 CA-C-O 120.919 0.39 . . . . 0.0 110.759 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.7 mm -60.66 -46.44 95.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.287 -178.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.5 m -59.12 -43.93 91.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.519 -177.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -59.64 -45.89 90.64 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.607 -178.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 66.0 mtt -58.26 -43.68 88.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.027 0.442 . . . . 0.0 110.347 -178.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -60.34 -48.56 81.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.35 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.4 tp -60.79 -33.6 73.23 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.051 -178.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.59 -49.57 74.74 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.647 0.261 . . . . 0.0 110.673 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.99 -41.97 88.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.015 0.436 . . . . 0.0 110.501 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 92.9 mt -54.22 -53.01 32.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.535 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -53.47 -21.75 6.77 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -58.26 -34.85 70.94 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.584 0.23 . . . . 0.0 111.542 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.6 mm -113.05 -37.77 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 120.679 0.276 . . . . 0.0 110.815 -176.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.5 t0 -116.7 77.4 8.25 Favored Pre-proline 0 CA--C 1.536 0.416 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.469 -177.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -54.85 -20.41 22.39 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 121.505 1.47 . . . . 0.0 113.416 -177.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 44.9 p90 -92.8 15.9 13.63 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -174.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -89.68 124.69 34.82 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 173.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.9 mmtp -97.54 -40.52 8.6 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.827 -175.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -153.09 157.52 40.53 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.574 -0.45 . . . . 0.0 111.503 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 46.7 mt -95.36 138.45 21.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.068 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.5 t -91.4 -46.42 14.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.801 176.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -154.72 156.56 36.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.006 178.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.7 p -143.11 132.65 23.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.016 0.436 . . . . 0.0 110.986 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.7 t -108.79 128.08 54.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.869 177.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.3 m -54.62 -39.06 67.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.226 -172.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -151.53 126.61 9.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.223 0.535 . . . . 0.0 111.742 -178.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 97.5 t -145.19 140.38 22.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.472 -177.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.52 149.85 50.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.068 -178.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -101.45 130.14 47.63 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.289 0.566 . . . . 0.0 111.649 -176.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -124.91 142.46 51.45 Favored 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.687 178.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 72.1 m -122.07 147.47 46.07 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 177.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -104.79 131.94 51.64 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.018 0.437 . . . . 0.0 110.268 175.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -104.44 116.45 32.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.885 178.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 86.4 p -68.47 -31.62 71.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.966 -177.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -62.79 -38.34 90.29 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.986 -177.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -93.89 -21.48 19.21 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 69.08 42.48 1.25 Allowed 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.246 0.546 . . . . 0.0 109.948 -178.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -153.12 166.38 32.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.124 -177.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -90.78 142.01 28.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.236 177.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -125.06 127.53 47.08 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 176.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -72.39 139.79 48.02 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 177.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.6 p -92.19 178.62 5.8 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.035 -179.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -89.01 16.12 7.54 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.0 t -112.29 106.4 20.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-O 120.946 0.403 . . . . 0.0 110.557 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -129.75 111.25 12.46 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 173.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.67 176.61 38.97 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 120.112 -1.042 . . . . 0.0 112.157 -168.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.33 137.0 37.83 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 175.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -100.06 127.69 46.25 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.219 -176.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -130.78 142.9 50.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.653 0.263 . . . . 0.0 110.319 177.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 67.4 mt -101.5 127.77 54.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 172.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 16.2 m-30 -108.48 137.32 46.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.939 0.4 . . . . 0.0 111.262 -175.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -117.58 143.34 46.21 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.143 176.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 51.4 ttt85 -139.85 147.53 40.81 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.8 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -86.91 28.14 0.93 Allowed 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.6 157.74 32.54 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -63.88 135.27 96.22 Favored Pre-proline 0 CA--C 1.539 0.553 0 CA-C-O 118.571 -0.728 . . . . 0.0 110.208 -176.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -66.71 140.86 51.98 Favored 'Cis proline' 0 N--CA 1.5 1.869 0 CA-C-N 121.66 1.629 . . . . 0.0 111.275 -3.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -68.14 -42.9 79.45 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.163 -176.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 74.6 m80 -143.03 140.58 31.04 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.622 0.725 . . . . 0.0 111.057 -176.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.8 t -150.08 152.31 34.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.056 -177.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 46.3 mt -111.48 137.71 42.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -178.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -131.83 142.03 49.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.042 -176.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.0 mt -123.44 133.75 68.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.195 0.521 . . . . 0.0 109.872 172.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -101.45 99.93 10.32 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.556 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -72.62 109.0 5.95 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 123.655 0.597 . . . . 0.0 111.037 -175.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -74.4 -40.39 62.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.2 -171.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 54.7 mt -71.19 -45.0 64.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.613 -175.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 53.2 m-20 -95.1 -3.13 48.64 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -175.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.3 p 51.17 42.2 28.51 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.439 0.638 . . . . 0.0 111.092 178.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 42.9 m -127.96 149.07 50.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.153 -0.93 . . . . 0.0 109.729 179.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.0 p -102.28 144.99 30.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.923 0.392 . . . . 0.0 111.161 -177.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -138.38 122.16 17.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.301 177.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 p -125.43 148.38 29.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.53 -0.304 . . . . 0.0 111.061 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -146.44 136.46 11.96 Favored Pre-proline 0 CA--C 1.537 0.48 0 CA-C-O 118.992 -0.528 . . . . 0.0 110.507 175.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.4 150.92 37.14 Favored 'Trans proline' 0 N--CA 1.498 1.771 0 C-N-CA 121.615 1.544 . . . . 0.0 112.484 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 71.3 mt -90.51 137.26 21.97 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-O 120.916 0.389 . . . . 0.0 110.317 177.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.9 p -132.18 155.39 48.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.708 177.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -96.45 32.0 6.92 Favored Glycine 0 CA--C 1.527 0.789 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.331 -178.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 63.4 p -100.85 -26.01 13.91 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 173.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.9 mt -69.01 147.35 51.72 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 120.889 0.375 . . . . 0.0 111.317 -176.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -116.2 135.84 53.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.638 175.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.3 mt -109.18 159.64 16.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.208 -174.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -148.9 141.36 24.26 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 178.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.8 t -98.82 109.21 22.0 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.725 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -106.85 103.61 48.0 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 172.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -71.32 139.65 35.39 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 CA-C-N 120.613 1.255 . . . . 0.0 112.012 -171.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -89.36 9.48 64.28 Favored 'Cis proline' 0 N--CA 1.5 1.897 0 CA-C-N 121.267 1.488 . . . . 0.0 113.737 -3.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -84.99 170.72 12.74 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.72 0.295 . . . . 0.0 110.858 -177.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 61.8 tp -118.75 132.75 56.15 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 170.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.8 tp -124.16 140.06 53.33 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.538 0.208 . . . . 0.0 110.583 -173.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 20.5 p90 -145.72 149.89 35.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.851 0.358 . . . . 0.0 110.562 175.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 54.5 mtm180 -106.71 148.17 28.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 -177.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -129.56 165.02 22.55 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.837 0.827 . . . . 0.0 111.433 -176.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -47.92 148.15 1.77 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.219 -177.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 54.7 ttt180 65.33 30.8 10.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.019 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 31.8 m 65.19 35.24 7.93 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.795 0.331 . . . . 0.0 111.575 165.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -99.74 145.95 27.09 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 85.2 mt -113.7 130.36 67.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.114 0.483 . . . . 0.0 109.81 -178.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -137.91 147.71 44.65 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.433 177.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.91 168.16 25.73 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 111.373 -0.691 . . . . 0.0 111.373 -176.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -125.2 140.41 52.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.803 0.335 . . . . 0.0 110.803 -179.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 21.9 t90 -106.89 123.82 48.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.584 175.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -113.33 141.55 46.89 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.824 0.345 . . . . 0.0 110.519 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -51.31 -35.82 39.64 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.672 178.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 -135.57 135.98 40.74 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.33 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 82.7 p -63.39 -40.23 96.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.144 -177.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -60.65 -43.3 97.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.356 0.598 . . . . 0.0 110.096 178.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -56.73 -45.8 81.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.563 0.697 . . . . 0.0 109.928 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 47.7 t -60.09 -38.13 82.01 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.811 178.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -59.48 -46.6 88.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.863 0.363 . . . . 0.0 110.514 -177.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 72.2 mtm180 -60.07 -48.16 82.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.008 0.433 . . . . 0.0 110.646 -177.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 28.9 mm -58.42 -44.94 89.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.072 -178.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.2 p -59.31 -44.3 92.57 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.679 -177.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.48 -44.42 93.71 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -178.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.3 mt -58.59 -48.41 81.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.185 0.517 . . . . 0.0 110.471 -178.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 54.3 t -58.63 -43.52 87.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.185 -178.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.8 m120 -58.2 -42.66 86.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.745 -178.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.97 -42.94 99.77 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.409 -0.676 . . . . 0.0 111.409 -178.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 50.1 mt -64.1 -43.27 95.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.759 0.314 . . . . 0.0 111.303 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 24.0 mt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.385 -176.349 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 11.6 mt . . . . . 0 C--O 1.233 0.201 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.1 139.61 15.18 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 121.083 1.189 . . . . 0.0 111.084 174.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -97.14 125.9 44.14 Favored Pre-proline 0 CA--C 1.535 0.396 0 CA-C-O 118.442 -0.789 . . . . 0.0 110.007 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -78.17 168.97 21.02 Favored 'Trans proline' 0 N--CA 1.496 1.643 0 C-N-CA 121.315 1.343 . . . . 0.0 111.734 176.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.91 152.55 57.12 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 C-N-CA 121.268 1.312 . . . . 0.0 111.344 177.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 6.1 mp -49.97 -25.23 3.12 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -176.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 84.9 m-85 -55.34 -37.65 67.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.742 0.306 . . . . 0.0 111.167 -176.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 58.2 t90 -61.78 -48.1 82.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.406 -176.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -62.01 -49.55 75.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.981 0.42 . . . . 0.0 110.52 -176.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -60.9 -46.05 92.18 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.083 -175.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 42.4 tp10 -59.29 -46.85 87.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.72 -175.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -61.58 -50.75 71.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.891 -176.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.5 tt0 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.373 -175.062 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.0 p . . . . . 0 C--O 1.23 0.049 0 CA-C-O 120.975 0.417 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.2 mm -59.75 -44.14 93.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.108 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 32.7 m -59.44 -45.18 92.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.534 -177.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -59.05 -45.96 89.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.369 -178.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.5 mtt -58.14 -43.92 87.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.188 0.518 . . . . 0.0 110.387 -177.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -59.95 -49.46 77.61 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.189 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.8 tp -58.79 -33.69 70.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.988 -178.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.05 -50.94 68.65 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.659 0.266 . . . . 0.0 110.891 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.85 -41.55 82.61 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.967 0.413 . . . . 0.0 110.5 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 88.8 mt -54.31 -52.93 34.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.627 178.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -51.43 -24.17 4.67 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt -58.56 -34.11 70.68 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 -177.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 43.7 mm -110.22 -42.05 4.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.79 0.329 . . . . 0.0 110.239 -177.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -116.25 79.23 8.6 Favored Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.137 -178.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -53.86 -19.96 16.45 Favored 'Trans proline' 0 N--CA 1.497 1.717 0 C-N-CA 121.54 1.493 . . . . 0.0 113.498 -176.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.3 p90 -95.96 15.23 21.08 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -174.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -91.65 126.59 36.79 Favored 'General case' 0 C--N 1.333 -0.121 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 173.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.6 ttmt -109.34 -38.0 5.6 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 120.835 -0.346 . . . . 0.0 111.37 -172.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -132.81 145.54 51.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.962 0.41 . . . . 0.0 111.157 -175.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 19.2 mt -100.45 133.44 43.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 171.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.1 t -90.57 -47.06 14.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.987 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -153.82 156.08 37.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.994 179.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.7 p -142.57 132.05 23.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.102 0.477 . . . . 0.0 110.917 179.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.0 t -108.52 127.37 53.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.731 177.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 86.9 p -54.78 -38.24 67.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.28 -172.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -151.19 126.36 9.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.215 0.531 . . . . 0.0 111.764 -178.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 97.3 t -145.28 140.12 22.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.32 -177.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -130.22 149.85 51.73 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.17 -177.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -96.85 133.55 41.32 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.313 0.578 . . . . 0.0 111.638 -176.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -125.77 140.91 52.29 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.404 177.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 86.2 m -123.0 144.06 49.51 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 177.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -105.31 130.24 53.48 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.901 0.381 . . . . 0.0 110.155 175.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -101.56 115.52 30.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.785 176.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.5 m -67.48 -33.18 74.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.895 -177.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.3 m -61.54 -38.08 86.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.631 0.253 . . . . 0.0 111.021 -177.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -94.92 -21.37 18.69 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 22.5 t30 68.99 45.44 0.92 Allowed 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.519 0.676 . . . . 0.0 109.558 -177.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 74.5 tt0 -155.96 151.63 27.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.203 -177.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 88.8 m95 -84.32 142.46 30.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.123 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -125.02 131.49 53.38 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.01 -0.366 . . . . 0.0 110.01 176.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 55.8 pttt -74.87 136.79 41.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.277 178.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.4 p -92.31 168.46 11.3 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.775 -0.37 . . . . 0.0 110.285 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -74.22 -18.49 60.74 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.5 t -75.51 106.39 5.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-O 121.042 0.448 . . . . 0.0 110.457 -178.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -133.29 110.95 10.43 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 174.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.61 176.54 38.92 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 120.277 -0.963 . . . . 0.0 112.252 -168.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.39 135.48 37.45 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 174.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -99.12 127.48 45.08 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.134 -176.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -130.72 142.4 50.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.297 177.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 66.5 mt -101.54 127.51 54.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 172.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 -108.47 136.22 48.46 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.994 0.426 . . . . 0.0 111.394 -175.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 79.0 t60 -112.05 143.34 43.22 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.247 174.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -142.01 146.58 35.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.041 178.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -86.89 28.04 0.94 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.267 -0.424 . . . . 0.0 112.081 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.6 169.53 24.21 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -64.02 125.29 87.67 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-O 118.441 -0.79 . . . . 0.0 110.018 -178.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -78.39 141.0 63.19 Favored 'Cis proline' 0 N--CA 1.497 1.677 0 CA-C-N 121.92 1.721 . . . . 0.0 111.831 -1.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -64.9 -41.5 95.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.993 -177.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -142.71 136.97 29.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.365 0.602 . . . . 0.0 110.935 -177.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.1 t -150.55 152.35 34.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.38 -178.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 43.0 mt -111.15 138.44 39.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 -178.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -131.88 142.0 49.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.955 -176.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 62.8 mt -123.5 132.76 70.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.255 0.55 . . . . 0.0 109.784 172.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -99.15 99.52 10.52 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.234 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 56.8 t-20 -76.56 107.82 9.1 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 121.748 0.785 . . . . 0.0 110.86 -174.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 60.7 ttm-85 -73.41 -35.98 65.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.516 -170.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.6 mt -71.47 -45.35 62.78 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.999 -173.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 42.1 p-10 -95.2 -3.35 47.9 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -177.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.7 m 58.32 44.25 18.8 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.497 0.665 . . . . 0.0 109.97 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 29.3 m -134.35 149.06 50.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.224 -177.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 10.8 p -101.85 144.99 29.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.283 -177.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -137.31 122.24 18.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.444 177.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 13.0 p -125.42 149.22 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-O 120.933 0.397 . . . . 0.0 111.177 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -147.83 131.35 8.26 Favored Pre-proline 0 CA--C 1.538 0.513 0 CA-C-O 118.747 -0.644 . . . . 0.0 110.241 176.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -75.35 150.84 37.25 Favored 'Trans proline' 0 N--CA 1.5 1.872 0 C-N-CA 121.475 1.45 . . . . 0.0 112.432 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 62.5 mt -90.69 123.01 42.67 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-O 120.846 0.355 . . . . 0.0 110.488 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 73.0 p -99.66 154.61 18.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.869 174.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -92.69 24.14 25.1 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.868 -179.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 38.8 p -111.03 -9.91 14.38 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 175.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.9 mt -67.74 140.39 56.72 Favored 'General case' 0 C--O 1.232 0.142 0 O-C-N 122.112 -0.367 . . . . 0.0 111.275 -176.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.9 tt0 -113.48 135.81 53.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.853 176.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 61.3 mt -113.61 161.31 17.59 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.75 -176.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -149.99 143.71 25.37 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.3 t -99.69 109.25 21.73 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.515 179.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -106.75 103.75 48.29 Favored Pre-proline 0 C--N 1.329 -0.321 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 173.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -67.92 140.1 49.36 Favored 'Trans proline' 0 N--CA 1.496 1.647 0 CA-C-N 120.403 1.179 . . . . 0.0 111.784 -172.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -89.76 9.24 64.61 Favored 'Cis proline' 0 N--CA 1.5 1.899 0 CA-C-N 121.239 1.478 . . . . 0.0 113.699 -5.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -89.58 172.79 8.71 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.607 0.241 . . . . 0.0 110.815 -176.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.8 tp -115.95 136.38 53.1 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 172.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 11.6 tp -129.5 140.64 51.2 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.617 0.246 . . . . 0.0 110.654 -174.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -146.39 157.32 43.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.808 0.337 . . . . 0.0 110.418 175.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.4 mtm105 -101.88 144.79 30.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.629 -177.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -127.49 163.02 25.03 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.951 0.881 . . . . 0.0 111.854 -176.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -47.77 149.98 1.16 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.36 -0.837 . . . . 0.0 112.177 -177.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 93.0 mtt180 62.21 30.8 17.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.158 -0.928 . . . . 0.0 112.102 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 69.6 m 65.74 35.23 6.97 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.866 0.365 . . . . 0.0 111.487 165.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 68.1 mtp180 -101.23 151.37 21.94 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 78.5 mt -111.37 126.75 68.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 -178.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 32.9 mtp180 -130.82 145.35 51.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.658 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -140.84 167.98 25.44 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -127.96 141.71 51.45 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.952 0.406 . . . . 0.0 110.882 -178.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 70.8 t90 -106.72 124.67 49.95 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.518 175.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -114.01 140.43 48.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.677 0.275 . . . . 0.0 110.512 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 68.9 t80 -51.7 -36.72 47.84 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.665 178.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 37.3 t-20 -134.46 135.66 42.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.438 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.3 m -61.22 -42.05 97.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.07 -177.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -59.85 -43.4 94.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.399 0.619 . . . . 0.0 110.136 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -56.78 -44.87 82.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.49 0.662 . . . . 0.0 110.079 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 45.9 t -59.7 -39.83 85.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.673 178.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -58.79 -44.86 90.83 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.848 0.356 . . . . 0.0 110.669 -177.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -60.79 -49.79 76.07 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.73 -177.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 32.9 mm -58.47 -44.57 89.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.051 0.453 . . . . 0.0 109.982 -178.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 60.1 p -59.79 -44.16 94.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.677 -177.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.66 -43.69 94.28 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.67 -0.972 . . . . 0.0 110.67 -178.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.1 mt -59.18 -49.01 79.49 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.118 0.485 . . . . 0.0 110.617 -178.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 53.8 t -58.9 -43.51 88.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.083 -178.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -58.03 -42.52 85.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.865 0.364 . . . . 0.0 110.674 -178.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.97 -41.47 99.66 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 -179.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 36.3 mt -62.5 -43.16 99.5 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.878 0.371 . . . . 0.0 111.119 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 79.9 mt . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.618 -176.739 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 13.2 mt . . . . . 0 CA--C 1.531 0.219 0 CA-C-O 119.04 -0.505 . . . . 0.0 109.762 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -79.19 139.93 15.25 Favored 'Trans proline' 0 N--CA 1.493 1.475 0 C-N-CA 121.178 1.252 . . . . 0.0 111.33 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 25.4 mmtp -97.16 125.69 44.87 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-O 118.85 -0.595 . . . . 0.0 109.798 178.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 9.4 Cg_exo -74.18 158.32 45.39 Favored 'Trans proline' 0 N--CA 1.497 1.732 0 C-N-CA 121.464 1.442 . . . . 0.0 112.11 172.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -53.63 157.11 10.3 Favored 'Trans proline' 0 N--CA 1.496 1.639 0 C-N-CA 121.381 1.387 . . . . 0.0 111.932 178.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 80.7 mt -49.98 -28.17 6.48 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -177.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -54.74 -37.58 66.09 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.922 0.391 . . . . 0.0 111.126 -177.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 41.9 t90 -60.85 -47.96 84.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.244 -178.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -59.93 -46.65 88.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.992 0.425 . . . . 0.0 110.307 -177.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -59.23 -45.97 89.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.661 -177.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -57.74 -44.71 86.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.573 -177.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.19 -47.56 85.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.673 -177.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 . . . . . 0 C--N 1.327 -0.406 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.828 -177.103 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.4 m . . . . . 0 CA--C 1.526 0.056 0 CA-C-O 120.924 0.393 . . . . 0.0 110.498 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.3 mm -59.64 -44.76 94.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.088 -179.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.4 m -59.25 -45.2 91.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.986 0.422 . . . . 0.0 110.481 -177.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.0 mmt180 -58.99 -45.72 89.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.468 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.8 mtt -58.26 -43.79 88.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.121 0.486 . . . . 0.0 110.44 -178.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -59.28 -48.37 81.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.21 -178.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.4 tp -60.36 -33.39 72.36 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.146 -179.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.91 -49.77 74.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.677 0.275 . . . . 0.0 110.662 179.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.06 -41.95 89.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.974 0.416 . . . . 0.0 110.434 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 93.5 mt -54.28 -52.85 34.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.627 178.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -51.85 -27.29 12.13 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -177.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -58.94 -32.81 69.93 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -177.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.1 mm -106.17 -44.95 8.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.026 0.441 . . . . 0.0 110.064 -177.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -117.12 79.16 10.56 Favored Pre-proline 0 CA--C 1.535 0.4 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.276 -177.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -54.32 -20.22 19.29 Favored 'Trans proline' 0 N--CA 1.497 1.721 0 C-N-CA 121.473 1.449 . . . . 0.0 113.561 -175.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 14.5 p90 -93.52 15.13 16.74 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -174.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -81.28 128.12 33.46 Favored 'General case' 0 C--N 1.334 -0.1 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 173.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -97.51 -40.36 8.7 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.704 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -159.03 159.88 35.22 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.679 -0.409 . . . . 0.0 111.408 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 39.8 mt -96.22 138.39 21.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.052 178.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.9 t -90.87 -47.21 14.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.856 176.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -154.0 158.13 40.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.933 178.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 18.6 p -143.89 133.24 23.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.971 0.415 . . . . 0.0 111.153 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.3 t -110.12 127.8 55.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.74 177.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.4 m -54.86 -39.75 68.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.206 -171.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -149.81 125.91 10.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.262 0.553 . . . . 0.0 111.818 -178.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 97.2 t -145.19 142.25 22.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.447 -177.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.59 149.84 51.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.164 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -99.01 131.43 45.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.233 0.539 . . . . 0.0 111.519 -177.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -125.82 144.23 50.73 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.807 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 80.4 m -121.32 148.56 44.17 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -109.8 130.84 55.48 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.874 0.368 . . . . 0.0 110.452 176.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 36.9 t-20 -101.07 113.0 25.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.834 176.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.1 m -67.5 -32.73 73.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.976 -177.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.5 m -62.31 -38.52 89.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.666 0.269 . . . . 0.0 111.043 -177.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -94.72 -21.41 18.77 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -178.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 27.2 t30 68.74 45.76 0.99 Allowed 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.485 0.659 . . . . 0.0 109.356 -177.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -151.42 151.23 31.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.07 -176.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 81.0 m95 -87.65 141.28 28.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.341 177.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -125.02 130.47 52.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.17 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -76.47 139.93 41.03 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.9 p -92.31 177.42 6.15 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.13 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.7 p30 -86.98 12.96 10.02 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.9 t -106.62 106.44 20.62 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-O 120.988 0.423 . . . . 0.0 110.377 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -130.1 112.55 13.53 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 174.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.56 38.96 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 120.157 -1.02 . . . . 0.0 112.148 -168.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -79.77 135.42 36.49 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 175.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -98.27 129.22 44.99 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.113 -176.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -132.57 143.4 49.68 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.103 177.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 69.9 mt -101.57 128.12 54.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 172.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 13.4 m-30 -108.42 135.91 48.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.991 0.424 . . . . 0.0 111.247 -175.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 83.4 t60 -116.37 143.35 45.66 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.917 176.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -141.98 148.18 38.16 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.121 179.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -86.82 28.06 0.93 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 116.264 -0.426 . . . . 0.0 112.059 179.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.72 162.57 38.57 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 24.8 mp0 -64.06 130.7 94.67 Favored Pre-proline 0 CA--C 1.539 0.535 0 CA-C-O 118.517 -0.754 . . . . 0.0 110.031 -177.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.46 140.93 69.28 Favored 'Cis proline' 0 N--CA 1.498 1.739 0 CA-C-N 121.795 1.677 . . . . 0.0 111.63 -1.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -65.6 -42.69 91.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.04 -177.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -141.8 139.04 32.64 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.426 0.631 . . . . 0.0 110.917 -176.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.2 t -150.79 151.96 33.11 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.294 -178.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.7 mt -108.33 139.14 31.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -179.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -131.8 141.99 49.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.741 -176.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.0 mt -127.15 129.96 71.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-O 121.204 0.526 . . . . 0.0 110.048 173.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -96.17 99.52 11.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.539 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.2 t-20 -71.12 105.23 3.3 Favored 'General case' 0 C--N 1.332 -0.182 0 O-C-N 123.66 0.6 . . . . 0.0 110.8 -176.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 77.0 mtp85 -73.58 -38.62 65.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.489 -170.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 62.8 mt -75.15 -45.2 42.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.658 -174.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -95.13 -3.26 48.28 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 -175.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 11.9 m 54.89 43.11 30.48 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 121.441 0.638 . . . . 0.0 110.652 177.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.3 m -125.98 148.63 49.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.579 -177.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 76.2 p -94.74 130.27 41.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.127 -179.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -123.51 122.27 37.78 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 174.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 39.5 t -125.53 147.05 30.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.796 -176.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -146.6 126.45 6.77 Favored Pre-proline 0 CA--C 1.539 0.554 0 CA-C-O 118.683 -0.675 . . . . 0.0 110.37 174.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -75.37 150.89 37.24 Favored 'Trans proline' 0 N--CA 1.498 1.762 0 C-N-CA 121.471 1.447 . . . . 0.0 112.418 178.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 67.3 mt -93.59 138.78 19.55 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 CA-C-O 120.967 0.413 . . . . 0.0 110.263 178.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 60.2 p -132.17 157.16 44.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.688 177.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -90.91 31.81 5.43 Favored Glycine 0 CA--C 1.528 0.854 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.296 -178.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 54.5 p -111.07 -17.99 13.13 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 174.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -67.82 141.52 56.46 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-O 120.926 0.393 . . . . 0.0 110.976 -175.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.7 tt0 -111.96 135.91 51.98 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.661 175.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 68.9 mt -115.39 156.92 24.67 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.945 0.402 . . . . 0.0 110.984 -176.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -148.85 142.4 25.39 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 177.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.0 t -99.05 109.14 21.91 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.668 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -106.8 103.71 48.3 Favored Pre-proline 0 C--N 1.328 -0.34 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 172.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -70.03 140.3 41.34 Favored 'Trans proline' 0 N--CA 1.497 1.699 0 CA-C-N 120.468 1.203 . . . . 0.0 112.013 -171.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -89.8 9.92 62.85 Favored 'Cis proline' 0 N--CA 1.501 1.922 0 CA-C-N 121.317 1.506 . . . . 0.0 113.756 -4.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -88.22 170.21 11.21 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.694 0.283 . . . . 0.0 110.981 -177.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 55.9 tp -116.55 133.77 55.62 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 171.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.7 tp -125.37 139.09 53.98 Favored 'General case' 0 C--N 1.333 -0.137 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 -174.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -143.93 151.96 40.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.998 0.428 . . . . 0.0 110.65 175.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 30.3 mtm180 -104.47 144.09 32.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.668 -177.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -129.09 166.5 19.15 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.917 0.865 . . . . 0.0 111.811 -176.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -47.7 148.29 1.58 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.279 -176.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 63.41 30.85 15.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.126 -0.943 . . . . 0.0 112.256 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 67.3 m 65.67 35.25 7.08 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.848 0.356 . . . . 0.0 111.526 166.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 27.7 mmt180 -99.26 145.9 26.78 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 82.7 mt -114.93 127.47 72.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 121.088 0.47 . . . . 0.0 109.792 -178.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -136.78 150.33 48.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.506 179.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.52 169.47 25.13 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 111.41 -0.676 . . . . 0.0 111.41 -175.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -125.21 138.56 54.12 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.998 0.428 . . . . 0.0 110.625 -178.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -106.45 120.37 41.74 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.893 -1.049 . . . . 0.0 109.583 177.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -112.77 139.75 48.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.809 0.337 . . . . 0.0 110.719 -178.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -51.58 -37.51 50.18 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.63 178.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.6 t-20 -132.96 135.65 45.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.764 0.316 . . . . 0.0 110.431 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.7 t -61.36 -42.05 98.07 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.051 -177.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 -59.65 -43.23 94.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.362 0.601 . . . . 0.0 110.152 178.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -56.91 -45.01 82.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.432 0.634 . . . . 0.0 109.998 178.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 46.5 t -59.51 -39.75 84.84 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.588 178.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -59.51 -45.41 91.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.8 0.334 . . . . 0.0 110.704 -177.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 -60.11 -49.35 78.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.054 0.454 . . . . 0.0 110.663 -177.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 31.7 mm -58.42 -44.86 89.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.974 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 55.8 p -59.31 -43.97 92.61 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.708 -177.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.61 -44.03 94.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -178.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.7 mt -58.47 -48.68 79.98 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.234 0.54 . . . . 0.0 110.514 -178.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 52.7 t -58.71 -43.13 87.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.156 -178.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 26.9 m120 -58.34 -42.35 86.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.849 0.357 . . . . 0.0 110.664 -178.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.77 -41.16 99.58 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 50.3 mt -63.97 -45.01 91.02 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.794 0.33 . . . . 0.0 111.18 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 36.1 mt . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.295 -176.246 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 21.9 mt . . . . . 0 C--O 1.233 0.198 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -78.99 139.66 15.41 Favored 'Trans proline' 0 N--CA 1.491 1.364 0 C-N-CA 120.915 1.076 . . . . 0.0 111.201 175.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 5.4 mmmm -97.28 125.93 43.73 Favored Pre-proline 0 CA--C 1.536 0.432 0 CA-C-O 118.456 -0.783 . . . . 0.0 109.966 178.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -78.18 168.47 21.76 Favored 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 121.257 1.305 . . . . 0.0 111.937 175.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -65.71 154.57 73.25 Favored 'Trans proline' 0 N--CA 1.495 1.562 0 C-N-CA 121.259 1.306 . . . . 0.0 111.305 175.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.3 tp -50.01 -29.62 9.01 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -176.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 65.3 t80 -54.96 -36.83 65.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.818 0.342 . . . . 0.0 111.349 -176.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 23.6 t90 -61.53 -48.15 82.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.423 -176.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -61.89 -49.15 77.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.121 0.486 . . . . 0.0 110.366 -178.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -58.82 -44.96 90.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.871 -176.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -59.04 -46.84 87.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.623 -176.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.38 -47.19 86.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.052 0.453 . . . . 0.0 110.652 -177.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 . . . . . 0 C--N 1.328 -0.366 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.013 -176.264 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.1 t . . . . . 0 CA--C 1.527 0.062 0 CA-C-O 120.904 0.383 . . . . 0.0 110.662 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.6 mm -59.93 -45.31 95.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.199 -178.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.9 m -59.14 -44.62 92.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.467 -178.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -59.43 -46.15 89.54 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.593 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 88.4 mtp -58.17 -43.72 87.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.053 0.454 . . . . 0.0 110.423 -178.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -59.99 -48.65 80.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.268 -178.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.8 tp -60.72 -32.89 72.13 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.729 -0.388 . . . . 0.0 111.175 -179.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.22 -49.86 74.08 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.726 0.298 . . . . 0.0 110.632 179.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.8 -42.13 88.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.057 0.456 . . . . 0.0 110.456 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 97.7 mt -54.28 -52.88 34.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.627 178.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -53.26 -23.7 9.58 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -57.93 -34.65 70.11 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 120.611 0.244 . . . . 0.0 111.575 -178.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 48.0 mm -107.77 -42.83 6.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.973 0.416 . . . . 0.0 110.208 -177.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -117.16 77.43 9.39 Favored Pre-proline 0 CA--C 1.535 0.372 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.808 -179.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -55.72 -21.19 31.13 Favored 'Trans proline' 0 N--CA 1.498 1.752 0 C-N-CA 121.524 1.482 . . . . 0.0 113.447 -174.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.7 p90 -87.47 -2.15 58.42 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -174.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.33 127.21 31.34 Favored 'General case' 0 N--CA 1.461 0.095 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 177.133 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -97.54 -40.35 8.69 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.653 -175.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -154.79 157.44 37.95 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.3 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 35.4 mt -93.87 136.75 24.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.824 177.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.5 t -87.41 -44.98 16.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.68 177.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -158.35 157.94 33.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.845 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.2 p -142.87 132.9 24.32 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.999 0.428 . . . . 0.0 111.266 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.6 t -109.98 125.74 53.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.663 176.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.1 m -54.84 -38.93 68.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.169 -172.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -148.89 126.45 11.67 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.247 0.546 . . . . 0.0 111.76 -178.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 97.3 t -145.2 140.19 22.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.333 -178.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.91 149.84 51.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.722 0.296 . . . . 0.0 111.268 -177.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -100.77 130.33 46.78 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.549 -176.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -126.23 143.96 50.95 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.73 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 96.2 m -123.51 146.73 47.86 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -108.64 132.0 54.33 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.962 0.41 . . . . 0.0 110.333 176.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -105.18 114.22 28.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.82 176.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 84.8 p -70.8 -29.69 65.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.0 -0.546 . . . . 0.0 112.338 -175.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.3 t -58.9 -39.23 80.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.805 0.336 . . . . 0.0 110.943 -177.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -100.58 -17.88 16.86 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.9 t30 69.82 48.05 0.59 Allowed 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.596 0.712 . . . . 0.0 109.46 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -153.57 151.62 29.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.774 -178.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -88.37 142.78 27.45 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.393 178.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -124.99 130.39 52.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.86 176.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.5 pttp -75.02 141.26 43.94 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 177.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 67.5 p -92.3 175.55 6.8 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.699 -0.401 . . . . 0.0 110.067 -179.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -85.31 13.28 6.72 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.7 t -107.95 106.36 20.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-O 121.014 0.435 . . . . 0.0 110.351 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -132.1 112.2 12.12 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 174.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.64 176.53 38.95 Favored Glycine 0 CA--C 1.52 0.389 0 C-N-CA 120.184 -1.007 . . . . 0.0 112.222 -168.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.97 135.37 36.91 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 175.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -98.94 127.75 44.94 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.107 -176.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -131.75 141.97 49.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.331 177.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 63.9 mt -101.59 129.24 53.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 173.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 10.3 m-30 -108.49 137.38 46.54 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.791 0.329 . . . . 0.0 111.213 -175.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 57.6 t60 -121.35 143.3 49.27 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.289 176.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 29.1 ttp180 -142.01 153.84 44.56 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.303 177.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -86.85 28.17 0.92 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.152 -179.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -155.78 152.87 29.0 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -63.95 133.55 95.62 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-O 118.5 -0.762 . . . . 0.0 110.243 -176.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -68.19 140.92 57.98 Favored 'Cis proline' 0 N--CA 1.499 1.794 0 CA-C-N 121.703 1.644 . . . . 0.0 111.45 -0.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -66.74 -41.32 88.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.135 -176.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -142.44 143.42 32.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.7 0.762 . . . . 0.0 111.249 -175.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.6 t -150.31 151.95 33.72 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.847 -179.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 48.2 mt -112.35 138.4 41.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 -177.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -131.79 142.09 49.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.03 -177.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.8 mt -123.06 131.87 72.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.252 0.549 . . . . 0.0 109.783 172.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -97.8 99.58 10.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.426 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -72.03 107.28 4.66 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 123.618 0.573 . . . . 0.0 110.992 -175.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -73.4 -41.96 62.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.278 -171.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 74.7 mt -70.3 -45.13 66.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.671 -175.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 39.9 m-20 -95.09 -3.23 48.48 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -175.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.8 p 51.07 42.31 28.43 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.523 0.678 . . . . 0.0 111.065 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 38.5 m -125.2 149.08 48.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.164 -179.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.4 p -98.2 137.73 36.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.999 -178.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -132.97 122.19 23.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.118 175.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 p -125.62 150.38 30.89 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.049 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -148.71 132.8 8.68 Favored Pre-proline 0 CA--C 1.538 0.503 0 CA-C-O 118.879 -0.581 . . . . 0.0 110.401 174.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -75.46 150.95 36.93 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 121.578 1.518 . . . . 0.0 112.29 179.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 69.7 mt -90.51 136.31 24.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.2 177.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.6 p -132.14 158.49 41.53 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.839 177.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -95.7 35.46 4.3 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.058 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.3 p -109.0 -23.33 11.74 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 173.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.89 147.68 51.34 Favored 'General case' 0 C--O 1.231 0.082 0 CA-C-O 120.887 0.375 . . . . 0.0 111.207 -176.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 59.3 tt0 -118.56 135.91 54.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.799 175.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 51.6 mt -114.25 161.05 18.34 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.715 -176.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -150.06 142.68 24.53 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 177.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.0 t -98.5 109.15 21.95 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.444 -0.502 . . . . 0.0 110.588 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 -106.9 103.75 48.74 Favored Pre-proline 0 C--N 1.328 -0.344 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 171.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -70.26 143.15 47.59 Favored 'Trans proline' 0 N--CA 1.497 1.734 0 CA-C-N 120.496 1.213 . . . . 0.0 112.003 -171.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -91.17 14.73 49.52 Favored 'Cis proline' 0 N--CA 1.499 1.798 0 CA-C-N 120.964 1.38 . . . . 0.0 113.561 -3.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -97.0 172.64 7.73 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.458 0.171 . . . . 0.0 110.58 -177.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 52.5 tp -114.5 135.07 54.52 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 173.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.4 tp -127.17 139.56 52.87 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 -174.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 19.6 p90 -146.61 160.9 41.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.91 0.386 . . . . 0.0 110.614 175.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 30.5 mtm105 -101.9 146.15 28.24 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.471 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 36.3 t30 -127.26 164.64 21.27 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.78 0.8 . . . . 0.0 111.732 -176.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -48.0 147.51 2.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.203 -176.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 63.23 30.95 15.78 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.152 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 46.5 t 66.62 35.2 5.45 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.896 0.379 . . . . 0.0 111.583 166.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -100.74 152.63 20.25 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 73.9 mt -110.19 129.18 65.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 -179.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -138.3 150.25 46.45 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.789 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -144.29 169.34 26.38 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 111.359 -0.696 . . . . 0.0 111.359 -176.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -125.34 140.96 52.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.948 0.404 . . . . 0.0 110.809 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 17.2 t90 -108.38 127.74 54.15 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.81 175.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -115.26 142.02 47.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.762 0.315 . . . . 0.0 110.356 178.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -50.93 -38.25 49.05 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.78 178.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -133.39 137.27 45.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.309 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.0 m -59.81 -41.74 91.92 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.957 -177.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -58.17 -42.24 85.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.285 0.564 . . . . 0.0 110.18 178.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -57.26 -44.78 84.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.508 0.67 . . . . 0.0 109.909 178.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 43.5 t -59.22 -37.01 76.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.797 176.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -63.11 -51.73 65.39 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 121.208 -0.197 . . . . 0.0 111.182 -174.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 29.6 ptt180 -64.76 -42.41 95.14 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.35 -0.54 . . . . 0.0 111.339 -175.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 26.5 mm -60.04 -48.13 89.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.175 0 C-N-CA 120.507 -0.477 . . . . 0.0 109.883 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 66.5 p -59.32 -43.2 92.71 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.832 0.349 . . . . 0.0 110.644 -177.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.77 -43.73 94.47 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.631 -0.987 . . . . 0.0 110.631 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.1 mt -57.93 -47.78 81.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.214 0.531 . . . . 0.0 110.497 -178.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 49.3 t -59.01 -44.14 90.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.035 -179.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -57.36 -42.74 82.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.689 -178.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.12 -46.02 95.37 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.006 -0.838 . . . . 0.0 111.006 -178.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 56.9 mt -57.83 -43.07 85.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.016 0.436 . . . . 0.0 110.507 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 39.3 mt . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.802 -179.838 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 8.3 mt . . . . . 0 CA--C 1.533 0.307 0 CA-C-O 118.169 -0.92 . . . . 0.0 109.412 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -79.14 139.55 15.08 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 CA-C-N 120.615 1.255 . . . . 0.0 111.155 174.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 41.6 mtmt -97.38 126.02 43.21 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-O 118.453 -0.784 . . . . 0.0 110.32 179.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -64.55 167.8 14.38 Favored 'Trans proline' 0 N--CA 1.498 1.757 0 CA-C-N 120.564 1.237 . . . . 0.0 111.619 175.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -56.55 157.11 19.74 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 121.402 1.401 . . . . 0.0 111.445 178.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 12.3 tp -50.01 -29.96 9.68 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -176.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 58.2 t80 -54.95 -37.42 66.43 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.921 0.391 . . . . 0.0 111.161 -177.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 43.6 t90 -60.2 -48.05 83.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.225 -177.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -61.88 -47.94 82.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.026 0.441 . . . . 0.0 110.626 -177.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -59.63 -45.09 93.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.86 -177.099 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 42.7 tp10 -59.23 -46.17 89.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.695 -176.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.26 -48.34 82.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.039 0.447 . . . . 0.0 110.751 -177.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 . . . . . 0 C--N 1.328 -0.359 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.15 -176.597 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.4 m . . . . . 0 CA--C 1.527 0.064 0 CA-C-O 120.908 0.385 . . . . 0.0 110.639 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.7 mm -59.56 -44.82 94.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.128 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.5 m -58.62 -45.07 90.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.061 0.458 . . . . 0.0 110.439 -178.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -59.26 -45.38 91.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.58 -178.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 89.2 mtp -58.27 -42.4 86.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.449 -178.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -60.1 -49.93 75.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.287 -178.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 12.7 tp -60.53 -31.02 70.12 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.323 -179.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.76 -50.92 67.17 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.676 0.274 . . . . 0.0 110.733 178.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.36 -40.23 81.7 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.953 0.406 . . . . 0.0 110.674 179.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 97.7 mt -54.24 -52.9 33.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.485 177.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -51.55 -22.38 3.2 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.9 mmtt -58.72 -35.09 72.12 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 122.296 -0.253 . . . . 0.0 111.631 -178.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 48.2 mm -108.19 -43.26 6.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.908 0.385 . . . . 0.0 110.116 -177.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -117.36 77.3 9.98 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.129 -176.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -54.84 -22.45 29.86 Favored 'Trans proline' 0 N--CA 1.498 1.747 0 C-N-CA 121.5 1.466 . . . . 0.0 113.33 -176.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.0 p90 -88.65 8.74 27.02 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -175.011 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -88.61 123.81 33.44 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 174.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -104.86 -40.06 6.07 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.991 -173.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -132.02 145.63 51.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.145 -176.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 63.0 mt -96.66 128.13 48.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.87 -0.604 . . . . 0.0 109.731 173.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.3 t -89.26 -47.11 15.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.047 0.451 . . . . 0.0 109.965 -179.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -154.22 150.26 27.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.023 177.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.8 p -138.46 131.95 30.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.059 0.456 . . . . 0.0 110.743 179.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.4 t -104.74 126.9 52.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.482 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.2 m -53.91 -38.03 64.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.366 -171.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -151.92 127.82 10.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.225 0.536 . . . . 0.0 111.724 -178.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 94.9 t -145.15 136.99 20.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.542 -177.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -126.36 149.86 48.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.173 -178.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -96.99 133.09 42.12 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.334 0.588 . . . . 0.0 111.788 -176.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -127.04 137.98 53.15 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.283 177.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.4 m -119.03 143.46 47.08 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 178.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -107.93 130.57 55.02 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.008 0.432 . . . . 0.0 110.246 177.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -101.76 113.74 27.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.063 176.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 86.1 p -70.88 -25.79 62.95 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -177.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.0 m -58.89 -36.4 74.61 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 121.121 -0.232 . . . . 0.0 111.244 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -113.95 -12.04 12.7 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -177.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 58.7 t30 69.74 50.51 0.49 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-O 121.704 0.764 . . . . 0.0 109.592 179.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.7 tp10 -148.01 146.93 29.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.908 -178.315 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 83.7 m95 -89.2 141.0 28.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.176 176.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -121.42 126.31 49.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.229 -0.441 . . . . 0.0 109.916 176.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -73.17 135.14 44.6 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 177.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 67.9 p -92.35 162.1 14.4 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.24 -177.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -75.95 5.68 6.21 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.3 t -97.16 106.42 18.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 121.091 0.472 . . . . 0.0 110.29 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -131.73 115.5 16.09 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 176.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.5 38.96 Favored Glycine 0 CA--C 1.52 0.392 0 C-N-CA 120.063 -1.065 . . . . 0.0 112.392 -169.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -80.94 136.47 36.04 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -102.18 123.8 46.65 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -175.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -128.53 140.92 51.55 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.644 0.259 . . . . 0.0 110.721 177.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 74.8 mt -101.63 127.35 55.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 170.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 11.2 m-30 -108.53 140.62 41.61 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.018 0.437 . . . . 0.0 111.665 -177.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -108.82 143.38 38.08 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.934 173.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -140.89 145.51 36.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.028 178.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -86.93 28.17 0.93 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.217 -0.447 . . . . 0.0 112.03 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.28 164.15 36.7 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -63.96 128.83 93.44 Favored Pre-proline 0 CA--C 1.539 0.557 0 CA-C-O 118.401 -0.809 . . . . 0.0 110.024 -177.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.61 140.9 69.9 Favored 'Cis proline' 0 N--CA 1.497 1.719 0 CA-C-N 121.909 1.717 . . . . 0.0 111.738 -1.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -63.97 -41.37 97.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.986 -177.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -143.15 137.94 29.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.315 0.579 . . . . 0.0 110.911 -177.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.0 t -150.04 151.63 33.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.421 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 56.7 mt -115.08 139.81 39.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.961 -177.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -131.79 142.09 49.65 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.082 -178.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.1 mt -119.84 126.69 75.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.207 0.527 . . . . 0.0 109.771 171.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -94.66 99.56 11.65 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.648 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -73.28 105.96 4.91 Favored 'General case' 0 C--N 1.332 -0.16 0 O-C-N 123.687 0.617 . . . . 0.0 110.934 -175.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 25.9 mmt85 -74.36 -40.48 62.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.447 -170.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 45.0 mt -74.07 -45.16 51.05 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.77 0.319 . . . . 0.0 111.411 -175.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 29.8 t-20 -95.04 -3.2 48.7 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -175.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.5 p 50.95 43.22 28.83 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.496 0.665 . . . . 0.0 111.147 178.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 37.2 m -122.97 142.94 50.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.143 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.2 p -91.83 127.97 37.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.29 -178.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -117.46 122.15 42.96 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 175.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 p -125.56 146.96 30.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-O 120.705 0.288 . . . . 0.0 111.08 -178.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -149.83 126.48 5.3 Favored Pre-proline 0 CA--C 1.539 0.546 0 CA-C-O 118.557 -0.735 . . . . 0.0 110.345 175.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -75.36 150.86 37.22 Favored 'Trans proline' 0 N--CA 1.498 1.765 0 C-N-CA 121.388 1.392 . . . . 0.0 112.105 177.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 63.1 mt -90.67 135.95 25.28 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 CA-C-O 120.937 0.399 . . . . 0.0 110.376 179.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.9 p -132.12 154.71 49.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.667 177.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -93.79 35.82 4.0 Favored Glycine 0 CA--C 1.525 0.68 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.048 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 46.7 p -111.0 -21.08 12.18 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 111.995 0.368 . . . . 0.0 111.995 174.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.6 mt -68.43 147.19 52.42 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-O 120.909 0.385 . . . . 0.0 111.367 -175.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.9 tt0 -114.31 135.82 53.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.768 176.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 60.4 mt -115.6 157.58 23.93 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.959 0.409 . . . . 0.0 110.882 -176.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -149.22 142.39 25.01 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 178.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.1 t -99.03 109.14 21.93 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.613 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -106.8 103.73 48.36 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 172.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -70.55 142.99 45.8 Favored 'Trans proline' 0 N--CA 1.497 1.72 0 CA-C-N 120.546 1.231 . . . . 0.0 112.138 -170.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -90.62 14.27 50.96 Favored 'Cis proline' 0 N--CA 1.5 1.901 0 CA-C-N 121.049 1.41 . . . . 0.0 113.534 -4.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -94.89 170.42 9.44 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 122.378 0.271 . . . . 0.0 110.758 -177.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 54.1 tp -116.1 133.2 56.28 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 173.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.8 tp -124.67 139.98 53.36 Favored 'General case' 0 C--N 1.334 -0.101 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 -173.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -144.5 153.09 41.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.972 0.415 . . . . 0.0 110.564 175.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.6 mtm180 -103.89 144.35 31.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.739 -177.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -127.57 163.05 25.02 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.893 0.854 . . . . 0.0 111.761 -176.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -47.84 149.24 1.35 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.14 -177.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 87.5 mtt-85 63.5 30.87 15.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.155 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 34.9 m 66.27 35.16 6.07 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.913 0.387 . . . . 0.0 111.628 165.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 40.3 mtp180 -99.87 147.32 25.65 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 82.9 mt -113.33 126.92 70.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -178.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -136.12 148.36 48.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.429 -178.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -144.73 169.3 26.62 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 120.771 -0.728 . . . . 0.0 111.651 -178.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -126.0 141.85 51.78 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.292 -0.454 . . . . 0.0 110.565 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 77.5 t90 -106.63 124.02 48.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.511 174.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -109.65 140.19 43.78 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 123.312 0.383 . . . . 0.0 110.523 -179.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -50.33 -37.13 35.15 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.845 178.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 39.1 t-20 -133.72 135.49 44.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.345 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.2 m -61.63 -42.77 99.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.056 -177.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -59.43 -43.64 93.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.373 0.606 . . . . 0.0 110.084 179.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -56.56 -43.7 80.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.133 178.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 51.4 t -59.31 -40.99 87.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.353 177.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -58.88 -44.57 91.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.8 0.333 . . . . 0.0 110.627 -177.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -59.99 -49.74 76.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.944 0.402 . . . . 0.0 110.649 -177.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 29.8 mm -58.46 -45.31 90.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.099 0.476 . . . . 0.0 110.067 -178.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 61.1 p -59.41 -43.03 93.1 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.73 -177.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.73 -43.99 94.3 Favored Glycine 0 CA--C 1.523 0.545 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 -178.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.8 mt -58.4 -48.21 81.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.074 0.464 . . . . 0.0 110.459 -178.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 55.4 t -59.0 -42.57 86.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.167 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 26.6 m120 -57.38 -42.07 81.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.896 0.379 . . . . 0.0 110.605 -179.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -59.65 -44.63 96.72 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 58.0 mt -57.68 -42.99 84.74 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.98 0.419 . . . . 0.0 110.429 179.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 17.7 mt . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.548 179.121 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 18.9 mt . . . . . 0 C--O 1.234 0.279 0 CA-C-O 118.461 -0.781 . . . . 0.0 109.488 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.21 139.65 15.04 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 CA-C-N 120.435 1.191 . . . . 0.0 111.083 174.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 19.8 mtmm -97.31 125.94 43.64 Favored Pre-proline 0 CA--C 1.535 0.401 0 CA-C-O 118.514 -0.755 . . . . 0.0 110.188 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -63.25 161.15 31.69 Favored 'Trans proline' 0 N--CA 1.498 1.759 0 CA-C-N 120.563 1.237 . . . . 0.0 111.553 176.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -49.19 157.04 2.07 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 121.38 1.386 . . . . 0.0 111.812 178.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 6.2 mp -49.99 -25.58 3.47 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -176.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 68.8 t80 -55.95 -38.46 70.39 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.809 0.337 . . . . 0.0 111.084 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 50.5 t90 -60.88 -48.08 83.42 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.509 -176.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -63.61 -49.27 73.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.067 0.46 . . . . 0.0 110.785 -177.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -59.34 -43.86 92.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.926 -176.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -59.19 -48.32 82.04 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.638 -176.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.17 -49.12 78.87 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.733 -177.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 61.7 tt0 . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.226 -176.046 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.1 m . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.911 0.386 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 48.2 mm -59.81 -44.7 94.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.216 -178.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.0 m -59.58 -44.05 93.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.571 -177.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -59.92 -45.2 93.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.563 -178.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 87.8 mtp -58.26 -44.21 88.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.093 0.473 . . . . 0.0 110.458 -178.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -60.75 -49.18 78.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.296 -178.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.4 tp -59.75 -33.02 71.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.058 -178.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.34 -50.58 69.44 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.649 0.262 . . . . 0.0 110.851 179.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.96 -41.67 83.38 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.944 0.402 . . . . 0.0 110.404 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 93.9 mt -54.13 -52.98 32.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.724 178.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -51.93 -24.76 6.85 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -178.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 65.8 mmtt -59.24 -33.73 71.37 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -177.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.6 mm -109.77 -43.67 5.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.0 0.429 . . . . 0.0 110.071 -176.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -117.61 77.15 10.7 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.968 -178.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -55.2 -20.49 24.78 Favored 'Trans proline' 0 N--CA 1.497 1.731 0 C-N-CA 121.47 1.447 . . . . 0.0 113.531 -175.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.3 p90 -90.61 11.62 21.44 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -174.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -88.15 131.21 34.8 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 174.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -108.31 -38.69 5.66 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.745 0.307 . . . . 0.0 111.145 -175.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -135.86 147.65 48.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.007 0.432 . . . . 0.0 111.183 -175.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 21.8 mt -99.39 134.28 39.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 171.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.6 t -92.83 -47.13 13.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.242 -0.435 . . . . 0.0 109.877 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -152.23 155.06 36.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.014 178.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.1 p -142.7 131.95 23.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.171 0.51 . . . . 0.0 110.895 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.6 t -107.27 126.58 52.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.695 177.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.7 t -54.38 -38.67 66.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.154 -172.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 -150.7 127.21 10.78 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.294 0.569 . . . . 0.0 111.689 -179.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 92.8 t -144.84 138.55 22.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.336 -178.094 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.59 149.81 50.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.303 -177.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -99.68 131.2 45.82 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.259 0.552 . . . . 0.0 111.833 -176.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -123.85 141.75 51.75 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.466 178.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 72.5 m -120.99 147.01 46.08 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -107.79 131.9 53.97 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.951 0.405 . . . . 0.0 110.416 175.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.6 t-20 -104.31 115.65 30.76 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.977 178.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 27.1 t -67.65 -33.12 74.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.9 -177.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.1 m -60.56 -39.79 89.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.752 0.31 . . . . 0.0 110.887 -177.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -93.13 -21.52 19.63 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 19.2 t30 69.13 42.69 1.2 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-O 121.288 0.566 . . . . 0.0 109.809 -177.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.0 mt-10 -151.34 164.17 37.29 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.156 -177.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 83.9 m95 -94.12 141.66 28.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.352 177.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.9 tp10 -124.97 127.53 47.17 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 177.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.7 ttpp -73.64 139.15 45.25 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 177.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 52.4 p -92.23 172.23 8.55 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.071 -178.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -84.08 12.6 6.13 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 178.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.7 t -104.05 106.43 20.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-O 121.068 0.461 . . . . 0.0 110.346 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -132.22 114.43 14.45 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 176.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.59 176.51 38.91 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.022 -1.085 . . . . 0.0 112.3 -169.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -81.31 135.81 35.73 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 175.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -99.42 127.34 45.46 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.883 -0.327 . . . . 0.0 110.126 -176.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -131.67 142.46 49.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.723 0.297 . . . . 0.0 110.339 177.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 68.6 mt -101.61 127.95 54.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 171.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 16.3 m-30 -108.53 135.55 49.61 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.855 0.36 . . . . 0.0 111.302 -175.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 68.8 t60 -109.71 143.28 39.72 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.104 174.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 60.5 ttt180 -141.92 146.75 36.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.233 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -86.88 28.11 0.93 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.112 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.7 166.16 33.53 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -63.99 127.64 92.03 Favored Pre-proline 0 CA--C 1.539 0.537 0 CA-C-O 118.445 -0.788 . . . . 0.0 110.066 -177.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -75.98 140.94 68.94 Favored 'Cis proline' 0 N--CA 1.497 1.702 0 CA-C-N 121.89 1.711 . . . . 0.0 111.765 -1.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -62.45 -42.26 99.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.945 -178.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -142.84 138.58 30.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.436 0.636 . . . . 0.0 110.891 -177.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.8 t -150.19 151.73 33.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.311 -178.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 47.7 mt -110.31 139.81 32.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -131.78 142.03 49.64 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.761 -176.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 59.7 mt -124.62 128.99 73.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.249 0.547 . . . . 0.0 110.06 173.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -96.26 99.54 11.24 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.53 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.2 t-20 -74.7 106.29 6.19 Favored 'General case' 0 C--N 1.331 -0.209 0 O-C-N 123.647 0.592 . . . . 0.0 110.933 -175.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 71.2 mtm180 -73.16 -43.91 60.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.588 -170.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 29.8 mt -72.56 -45.09 60.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.634 -174.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 37.2 t-20 -95.13 -3.11 48.57 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -174.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 73.0 p 50.73 42.9 28.0 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.478 0.656 . . . . 0.0 111.186 177.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.0 m -125.43 133.87 52.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.275 -179.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 80.4 p -80.16 130.45 35.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.301 -178.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -118.46 122.22 42.19 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 174.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 34.6 t -125.48 145.62 32.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-O 120.725 0.298 . . . . 0.0 110.674 -177.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -148.26 126.41 5.93 Favored Pre-proline 0 CA--C 1.538 0.492 0 CA-C-O 118.64 -0.695 . . . . 0.0 110.496 174.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -75.42 150.9 37.02 Favored 'Trans proline' 0 N--CA 1.5 1.875 0 C-N-CA 121.462 1.442 . . . . 0.0 112.184 177.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 66.5 mt -92.15 133.09 34.69 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.31 178.257 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.6 p -132.21 159.54 38.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.732 177.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -94.54 36.69 3.67 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.96 -178.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 51.7 p -111.07 -22.49 11.44 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 174.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.84 145.04 54.07 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-O 120.878 0.37 . . . . 0.0 111.251 -176.062 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 57.5 tt0 -116.93 135.78 53.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.729 175.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 63.2 mt -113.28 159.19 19.62 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.702 -176.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -150.02 143.94 25.49 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 178.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 29.3 t -99.59 109.15 21.68 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.462 -0.495 . . . . 0.0 110.326 178.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 19.3 mm-40 -106.83 103.75 48.55 Favored Pre-proline 0 C--N 1.329 -0.317 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 172.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -67.38 142.37 59.68 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 CA-C-N 120.491 1.211 . . . . 0.0 111.787 -172.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -90.76 12.73 55.38 Favored 'Cis proline' 0 N--CA 1.5 1.899 0 CA-C-N 121.146 1.445 . . . . 0.0 113.493 -4.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -94.9 170.17 9.62 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 122.304 0.242 . . . . 0.0 110.618 -176.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 58.0 tp -111.99 134.91 53.25 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 171.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.6 tp -126.88 139.65 52.92 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.5 0.191 . . . . 0.0 110.606 -173.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 50.9 p90 -145.5 156.81 43.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.798 0.332 . . . . 0.0 110.534 175.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.8 mtm105 -102.07 146.89 27.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.66 -178.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -126.47 163.81 22.52 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.591 0.71 . . . . 0.0 111.374 -177.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -47.16 144.86 2.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.192 -177.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 31.9 ttt85 65.27 30.92 11.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.416 -0.811 . . . . 0.0 112.021 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.5 p 65.59 35.24 7.22 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.871 0.367 . . . . 0.0 111.719 166.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 91.7 mtt-85 -98.0 152.74 18.95 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 78.3 mt -114.58 127.58 72.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -177.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -137.56 150.32 47.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.675 178.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.06 169.3 25.03 Favored Glycine 0 CA--C 1.522 0.53 0 N-CA-C 111.346 -0.702 . . . . 0.0 111.346 -176.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -125.3 139.78 53.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.902 0.382 . . . . 0.0 110.894 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 66.5 t90 -107.1 121.57 44.75 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.574 174.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -111.74 140.19 46.58 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.131 0.269 . . . . 0.0 110.461 179.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -49.93 -37.72 33.03 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.793 178.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 46.3 t-20 -134.76 131.43 37.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.107 178.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.4 p -57.14 -38.24 73.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.884 -179.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -57.81 -44.84 86.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.524 0.678 . . . . 0.0 109.962 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -57.28 -45.28 84.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.026 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 47.5 t -59.3 -39.59 83.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.612 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -60.07 -46.26 90.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.908 0.385 . . . . 0.0 110.705 -177.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -59.96 -48.96 79.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.652 -177.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 31.7 mm -58.62 -44.74 90.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.037 -178.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 57.6 p -59.46 -43.82 93.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.739 -177.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.78 -44.74 94.08 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.687 -0.965 . . . . 0.0 110.687 -178.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.1 mt -58.32 -47.64 83.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.115 0.483 . . . . 0.0 110.501 -178.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 51.7 t -59.15 -43.41 89.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.137 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -57.25 -41.95 80.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.907 0.384 . . . . 0.0 110.673 -178.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.55 -46.27 94.64 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 -179.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 72.4 mt -58.55 -42.62 88.29 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.943 0.401 . . . . 0.0 110.662 -179.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 48.1 mt . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.82 -179.086 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 13.5 mt . . . . . 0 CA--C 1.531 0.219 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -79.11 139.86 15.35 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 C-N-CA 121.229 1.286 . . . . 0.0 111.339 175.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 27.5 mmtp -97.13 125.76 44.69 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 118.889 -0.577 . . . . 0.0 110.225 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -74.09 155.72 47.33 Favored 'Trans proline' 0 N--CA 1.495 1.613 0 C-N-CA 121.429 1.419 . . . . 0.0 111.704 172.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -51.73 154.76 8.91 Favored 'Trans proline' 0 N--CA 1.494 1.554 0 C-N-CA 121.361 1.374 . . . . 0.0 111.783 178.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 26.0 tp -49.91 -29.17 7.76 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -177.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 64.7 t80 -54.93 -37.12 66.0 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.898 0.38 . . . . 0.0 111.228 -176.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 34.2 t90 -60.55 -48.14 83.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.261 -177.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -62.58 -48.8 77.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.119 0.485 . . . . 0.0 110.57 -177.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -59.2 -42.62 91.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.938 -176.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -59.12 -48.52 81.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.861 0.362 . . . . 0.0 110.594 -176.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.63 -48.94 79.71 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.601 -177.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.7 tt0 . . . . . 0 C--N 1.326 -0.431 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.174 -176.505 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.5 m . . . . . 0 CA--C 1.527 0.081 0 CA-C-O 120.899 0.38 . . . . 0.0 110.768 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mm -60.29 -47.08 93.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.991 0.424 . . . . 0.0 110.051 -178.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 35.3 m -58.98 -44.62 91.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.448 -177.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -59.22 -45.0 92.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.608 -178.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 44.1 ttm -58.34 -44.01 88.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.025 0.44 . . . . 0.0 110.319 -178.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 29.7 m120 -60.13 -49.62 76.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.271 -178.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.8 tp -59.62 -33.25 71.27 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.066 -178.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.04 -50.35 70.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.632 0.254 . . . . 0.0 110.798 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.04 -41.77 83.97 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.018 0.437 . . . . 0.0 110.455 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 94.9 mt -54.16 -52.96 32.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.66 178.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -52.51 -23.69 6.7 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -178.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.1 tttm -59.0 -33.65 70.95 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 -177.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.9 mm -109.89 -42.9 5.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.942 0.401 . . . . 0.0 110.204 -177.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -116.85 80.07 10.66 Favored Pre-proline 0 CA--C 1.535 0.375 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.341 -176.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -54.2 -22.59 26.43 Favored 'Trans proline' 0 N--CA 1.498 1.741 0 C-N-CA 121.533 1.489 . . . . 0.0 113.379 -176.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -92.1 14.42 16.04 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 -174.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -91.78 121.46 33.43 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 173.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -104.37 -39.83 6.31 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.135 -172.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -134.31 147.72 50.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.099 -176.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 22.6 mt -99.6 133.25 43.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 172.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.8 t -92.48 -47.25 14.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.983 179.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -153.07 151.15 29.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.84 178.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.1 p -139.02 132.04 29.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.059 0.457 . . . . 0.0 110.925 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.6 t -106.28 125.83 51.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.63 176.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.7 m -54.04 -37.85 64.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.241 -173.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 64.6 t-80 -151.52 126.94 10.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.331 0.586 . . . . 0.0 111.737 -179.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 94.8 t -144.97 140.83 23.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.399 -178.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.48 149.92 51.05 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.211 -177.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -98.32 131.96 44.19 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.35 0.595 . . . . 0.0 111.889 -176.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -124.58 143.18 50.84 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.6 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 86.1 m -121.94 144.76 48.68 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -106.5 131.96 53.07 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.881 0.372 . . . . 0.0 110.116 175.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 -103.62 115.05 29.79 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.828 177.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.7 t -67.93 -32.56 73.1 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.958 -176.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.4 m -60.29 -39.06 85.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.663 0.268 . . . . 0.0 110.996 -177.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -95.82 -21.46 18.09 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 69.71 44.37 0.87 Allowed 'General case' 0 C--O 1.232 0.181 0 CA-C-O 121.402 0.62 . . . . 0.0 109.697 -178.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -150.4 162.68 40.09 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.143 -177.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 85.3 m95 -94.94 140.08 30.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.403 178.24 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -122.26 130.33 53.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.076 177.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.9 pttp -75.43 139.27 42.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.293 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.7 p -92.33 169.4 10.61 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.651 -0.419 . . . . 0.0 109.95 178.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.1 p30 -85.79 13.11 7.73 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 177.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 40.2 t -104.11 106.44 20.32 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-O 121.025 0.441 . . . . 0.0 110.313 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -130.76 114.59 15.54 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 176.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -161.94 176.47 38.38 Favored Glycine 0 CA--C 1.519 0.338 0 C-N-CA 120.099 -1.048 . . . . 0.0 112.451 -169.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -79.71 136.28 36.74 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 175.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -101.44 123.5 45.6 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 120.952 -0.299 . . . . 0.0 110.23 -176.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -128.25 141.16 51.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.629 0.252 . . . . 0.0 110.658 177.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.415 HD13 HG22 ' A' ' 54' ' ' ILE . 74.6 mt -101.5 127.06 55.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 171.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 12.3 m-30 -108.55 138.94 44.03 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.956 0.408 . . . . 0.0 111.346 -177.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 61.5 t60 -108.81 143.38 38.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.912 174.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 64.3 ttt180 -140.47 145.85 37.46 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.025 177.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.9 m120 -86.97 28.18 0.94 Allowed 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.268 -0.423 . . . . 0.0 112.045 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.31 166.09 33.17 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 179.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -64.05 127.91 92.4 Favored Pre-proline 0 CA--C 1.54 0.574 0 CA-C-O 118.463 -0.779 . . . . 0.0 109.949 -177.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -75.66 140.98 69.52 Favored 'Cis proline' 0 N--CA 1.497 1.702 0 CA-C-N 121.835 1.691 . . . . 0.0 111.741 -1.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -62.73 -41.87 99.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.955 -177.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 73.5 m80 -143.25 139.55 30.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.359 0.6 . . . . 0.0 110.908 -177.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.4 t -149.99 151.76 33.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.345 -178.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 51.7 mt -114.68 138.92 43.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 -177.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -131.82 142.16 49.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.391 -178.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.5 mt -121.07 129.63 75.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.248 0.547 . . . . 0.0 109.738 172.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -97.21 99.54 11.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.492 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -73.31 106.06 4.97 Favored 'General case' 0 C--N 1.332 -0.188 0 O-C-N 123.702 0.626 . . . . 0.0 111.013 -175.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.2 ttm180 -72.85 -43.39 62.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.416 -171.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 52.6 mt -70.3 -45.25 66.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.605 -174.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 39.0 m-20 -95.1 -3.17 48.57 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -175.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 67.4 p 51.63 43.15 30.01 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.55 0.69 . . . . 0.0 110.996 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.1 m -124.85 142.02 51.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.277 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.3 p -88.58 133.66 34.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.389 -178.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -123.69 122.09 37.19 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 175.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.8 p -125.57 147.34 30.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 120.836 0.35 . . . . 0.0 111.109 -178.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -149.8 126.49 5.31 Favored Pre-proline 0 CA--C 1.539 0.534 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.203 175.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -75.39 150.91 37.17 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 121.371 1.38 . . . . 0.0 112.067 178.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 64.9 mt -89.78 115.81 30.03 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.328 179.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 66.0 p -97.92 159.01 15.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.94 176.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -95.4 24.96 26.79 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.817 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.3 p -111.07 -10.9 14.33 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 175.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.0 mt -67.96 135.16 51.94 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.856 0.36 . . . . 0.0 111.423 -175.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -111.05 135.92 50.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.768 175.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 66.6 mt -113.91 161.15 17.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.998 0.428 . . . . 0.0 111.056 -175.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -150.04 140.93 22.82 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 177.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.2 t -102.27 109.2 20.81 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.582 -0.447 . . . . 0.0 111.046 -178.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -106.82 103.75 48.52 Favored Pre-proline 0 C--N 1.329 -0.301 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 170.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -69.56 141.85 47.16 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 CA-C-N 120.654 1.269 . . . . 0.0 111.811 -172.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -90.08 11.94 57.5 Favored 'Cis proline' 0 N--CA 1.499 1.816 0 CA-C-N 121.068 1.417 . . . . 0.0 113.628 -3.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -90.86 169.54 10.84 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.686 0.279 . . . . 0.0 110.765 -178.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 50.7 tp -118.77 134.66 54.98 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 171.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.3 tp -125.58 140.37 52.79 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.637 0.256 . . . . 0.0 110.426 -175.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 22.2 p90 -145.42 155.09 42.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.787 0.327 . . . . 0.0 110.239 175.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.1 mtm105 -101.98 147.75 26.18 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.877 0.37 . . . . 0.0 110.624 -177.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -128.85 165.65 20.58 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.731 0.777 . . . . 0.0 111.523 -176.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -47.11 146.93 1.6 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.553 -0.748 . . . . 0.0 112.285 -177.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 63.33 30.92 15.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.227 179.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.5 p 66.26 35.25 6.05 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.729 0.3 . . . . 0.0 111.685 166.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -98.87 152.78 19.37 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 86.5 mt -115.46 126.96 73.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -178.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -133.92 150.24 51.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.58 178.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.6 167.38 25.89 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 111.351 -0.7 . . . . 0.0 111.351 -176.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -125.38 139.53 53.59 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.517 -0.341 . . . . 0.0 110.663 -179.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 7.6 t90 -107.16 125.72 51.46 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.417 174.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -113.52 141.8 46.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.792 0.329 . . . . 0.0 110.625 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -51.43 -35.32 38.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.691 178.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.2 t-20 -137.38 136.75 38.17 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.755 0.312 . . . . 0.0 110.403 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 25.1 m -61.38 -42.56 98.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.107 -177.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -57.84 -43.2 85.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.368 0.604 . . . . 0.0 110.106 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -57.03 -45.9 82.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.869 178.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 43.0 t -59.6 -37.74 79.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.889 178.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -61.73 -50.08 73.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.656 0.265 . . . . 0.0 110.856 -175.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -61.65 -44.75 96.38 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.987 -176.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 23.1 mm -59.52 -46.86 92.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 19.3 m -58.55 -44.62 89.71 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.563 -177.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.39 -43.33 93.91 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 -178.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.7 mt -58.25 -49.45 77.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.143 0.497 . . . . 0.0 110.489 -178.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 54.5 t -58.8 -43.87 89.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.171 -177.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -59.05 -42.3 89.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.825 -178.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.94 -41.94 99.7 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 111.407 -0.677 . . . . 0.0 111.407 -178.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 20.8 mt -63.67 -43.54 96.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.788 0.328 . . . . 0.0 111.181 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 66.9 mt . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.437 -176.483 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 16.1 mt . . . . . 0 C--O 1.234 0.259 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -79.14 139.82 15.26 Favored 'Trans proline' 0 N--CA 1.491 1.351 0 C-N-CA 121.166 1.244 . . . . 0.0 111.215 174.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -97.2 125.78 44.46 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-O 118.796 -0.621 . . . . 0.0 109.861 178.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -75.09 163.43 35.15 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 121.425 1.417 . . . . 0.0 111.694 173.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.56 157.2 32.9 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 121.341 1.36 . . . . 0.0 111.341 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 26.4 tp -50.06 -27.61 5.85 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -176.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -54.61 -36.7 64.74 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.867 0.365 . . . . 0.0 111.294 -177.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 39.2 t90 -61.08 -48.13 83.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.247 -177.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -61.2 -46.35 90.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.051 0.453 . . . . 0.0 110.477 -178.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -59.35 -44.71 92.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.722 -177.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -58.28 -46.33 86.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.451 -176.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.07 -47.74 84.6 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.631 -178.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.2 tt0 . . . . . 0 C--N 1.326 -0.414 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.951 -177.123 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.5 p . . . . . 0 CA--C 1.527 0.084 0 CA-C-O 120.756 0.312 . . . . 0.0 110.941 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 43.7 mm -62.29 -40.78 89.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.372 179.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.9 m -63.49 -49.97 71.47 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.679 -176.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.7 ptt180 -61.88 -37.45 84.61 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.799 -178.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 44.0 ttm -58.68 -46.21 87.72 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.151 0.5 . . . . 0.0 110.143 179.252 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -59.67 -48.92 79.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.195 -178.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.3 tp -59.74 -32.97 71.06 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.651 -0.419 . . . . 0.0 111.177 -178.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.84 -50.53 70.59 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.654 0.264 . . . . 0.0 110.701 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.64 -41.74 86.7 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.43 179.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 95.3 mt -54.19 -52.94 33.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.649 178.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -54.15 -21.6 9.17 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -178.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -58.64 -33.96 70.66 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 111.727 0.269 . . . . 0.0 111.727 -178.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.6 mm -113.0 -40.15 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-O 120.722 0.296 . . . . 0.0 110.531 -177.015 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -117.05 77.38 8.99 Favored Pre-proline 0 CA--C 1.535 0.368 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.214 -178.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -55.39 -20.71 26.86 Favored 'Trans proline' 0 N--CA 1.498 1.76 0 C-N-CA 121.536 1.49 . . . . 0.0 113.459 -175.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.8 p90 -90.77 9.94 28.04 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -174.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -84.62 122.32 28.88 Favored 'General case' 0 C--O 1.231 0.11 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 174.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.4 ttpt -97.49 -40.54 8.61 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.887 -173.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -148.44 153.06 38.0 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.586 -0.445 . . . . 0.0 111.433 -178.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 29.9 mt -94.38 138.3 20.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.848 178.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.2 t -92.58 -47.17 14.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.839 177.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -152.88 155.06 36.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.019 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.8 p -141.86 132.02 24.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.044 0.449 . . . . 0.0 110.943 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.5 t -108.49 126.45 52.93 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.647 177.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.4 t -54.58 -38.85 67.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.28 -172.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -150.45 126.8 10.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.225 0.536 . . . . 0.0 111.558 -179.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 96.2 t -145.19 140.43 22.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.309 -177.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.64 149.76 51.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.725 0.298 . . . . 0.0 111.314 -177.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -98.63 130.83 45.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.27 -177.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -125.31 142.08 51.71 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.599 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 64.1 m -120.38 145.86 46.75 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 178.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -108.27 131.87 54.26 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 121.011 0.434 . . . . 0.0 110.433 176.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -104.11 115.45 30.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.888 177.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.0 t -67.63 -32.51 73.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.918 -177.307 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.1 t -60.44 -40.26 90.44 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.726 0.298 . . . . 0.0 110.82 -177.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 98.0 mm-40 -93.8 -21.36 19.34 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 69.66 43.48 0.98 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-O 121.436 0.636 . . . . 0.0 109.803 -177.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -151.51 162.97 40.05 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.037 -177.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 89.0 m95 -94.33 141.76 28.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.336 177.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -124.01 130.42 52.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 0.0 109.958 176.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -72.42 139.21 47.65 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 177.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 77.3 p -92.35 179.04 5.66 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.298 -178.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -88.67 15.17 8.57 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -179.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.4 t -111.88 106.42 20.73 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 CA-C-O 120.982 0.42 . . . . 0.0 110.273 178.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -132.19 112.93 12.7 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 174.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.52 38.96 Favored Glycine 0 CA--C 1.52 0.4 0 C-N-CA 120.202 -0.999 . . . . 0.0 112.213 -168.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.47 135.95 37.49 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 174.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -101.26 127.04 48.03 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.346 -175.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -130.76 142.09 50.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.765 0.316 . . . . 0.0 110.308 177.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 66.3 mt -101.62 127.58 54.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 172.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 16.2 m-30 -108.48 137.62 46.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.997 0.427 . . . . 0.0 111.208 -175.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 30.1 t60 -116.7 143.31 45.79 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.967 175.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -141.22 147.43 38.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.141 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -86.9 28.1 0.93 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.275 -0.421 . . . . 0.0 112.125 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.72 160.5 37.97 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 178.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -64.05 131.78 95.08 Favored Pre-proline 0 CA--C 1.539 0.547 0 CA-C-O 118.536 -0.745 . . . . 0.0 110.04 -176.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -71.13 140.88 67.16 Favored 'Cis proline' 0 N--CA 1.498 1.792 0 CA-C-N 121.701 1.643 . . . . 0.0 111.515 -1.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -65.22 -42.73 93.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.028 -177.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -143.52 140.97 30.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.494 0.664 . . . . 0.0 111.038 -177.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.3 t -150.42 152.39 34.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.211 -178.024 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 46.5 mt -112.58 138.13 42.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -178.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 79.2 t80 -131.83 142.02 49.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.972 -176.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.0 mt -123.62 133.23 69.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.18 0.514 . . . . 0.0 109.847 172.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -99.16 99.55 10.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.37 179.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -72.42 106.95 4.74 Favored 'General case' 0 C--N 1.332 -0.193 0 O-C-N 123.666 0.604 . . . . 0.0 111.092 -175.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 55.6 ttp180 -72.86 -41.04 65.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.198 -171.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 75.5 mt -70.51 -45.16 66.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.684 -175.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -95.01 -3.34 48.57 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -175.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.0 m 55.87 43.1 28.11 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 121.452 0.644 . . . . 0.0 110.57 177.064 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.6 m -131.78 149.03 52.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.229 -178.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.0 p -101.71 141.82 33.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.929 0.395 . . . . 0.0 110.933 -179.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -135.45 122.13 20.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.231 178.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.8 p -125.49 148.53 30.02 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-O 120.807 0.337 . . . . 0.0 111.035 -177.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -147.17 136.27 11.48 Favored Pre-proline 0 CA--C 1.537 0.456 0 CA-C-O 119.03 -0.509 . . . . 0.0 110.487 174.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.51 150.87 36.61 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 121.673 1.582 . . . . 0.0 112.411 179.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 68.8 mt -89.96 137.25 21.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.902 0.382 . . . . 0.0 110.165 177.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 61.6 p -132.15 159.47 38.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.866 177.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -95.79 36.04 4.03 Favored Glycine 0 CA--C 1.524 0.653 0 C-N-CA 120.845 -0.693 . . . . 0.0 111.914 -178.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.2 t -109.22 -21.97 12.31 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 174.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 74.8 mt -68.49 144.93 54.47 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-O 120.949 0.404 . . . . 0.0 111.492 -176.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 54.2 tt0 -114.78 135.87 53.71 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.715 175.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 67.6 mt -115.16 158.09 22.72 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.057 0.456 . . . . 0.0 111.11 -175.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -149.54 141.02 23.34 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 177.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.4 t -98.13 109.09 21.9 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.399 -0.521 . . . . 0.0 110.578 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -106.83 103.68 48.22 Favored Pre-proline 0 C--N 1.328 -0.355 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 172.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -71.41 142.22 40.41 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 CA-C-N 120.596 1.249 . . . . 0.0 112.025 -171.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -90.56 13.72 52.58 Favored 'Cis proline' 0 N--CA 1.499 1.844 0 CA-C-N 121.075 1.42 . . . . 0.0 113.541 -3.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -93.04 172.98 7.97 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 122.149 0.179 . . . . 0.0 110.721 -177.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 58.7 tp -115.94 135.7 53.73 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 171.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.2 tp -127.15 139.63 52.83 Favored 'General case' 0 C--N 1.334 -0.096 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 -174.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 9.4 p90 -148.84 153.79 38.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.951 0.405 . . . . 0.0 110.659 176.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 31.6 mtm180 -102.43 149.21 24.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.81 -176.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -129.73 166.53 19.68 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.791 0.805 . . . . 0.0 111.464 -177.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -47.77 145.01 3.01 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.249 -176.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 65.24 31.01 11.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.093 179.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 37.8 t 66.29 35.14 6.06 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.912 0.387 . . . . 0.0 111.578 166.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -98.25 152.77 19.06 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 179.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 78.0 mt -115.77 126.28 73.24 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 CA-C-O 121.061 0.458 . . . . 0.0 109.993 -177.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 85.7 mmt-85 -127.95 149.4 50.35 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.276 178.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -140.54 164.69 26.27 Favored Glycine 0 CA--C 1.522 0.517 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 -178.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 32.9 m-85 -125.35 136.65 53.67 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.442 -0.379 . . . . 0.0 110.856 -178.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -107.41 126.35 52.38 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.735 175.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -117.84 142.67 47.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.799 0.333 . . . . 0.0 110.51 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -51.15 -34.72 32.37 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.769 178.252 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -137.62 136.92 37.96 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.767 0.318 . . . . 0.0 110.469 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.0 p -61.69 -40.48 95.15 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.161 -177.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -59.72 -43.67 94.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.407 0.622 . . . . 0.0 110.095 178.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -56.73 -45.32 82.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.979 179.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 43.0 t -60.22 -39.69 87.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.728 178.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -59.21 -45.65 90.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.77 0.319 . . . . 0.0 110.562 -176.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -60.62 -49.04 79.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.744 -177.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 31.6 mm -58.46 -44.98 90.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.039 -178.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 68.1 p -59.74 -44.37 93.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.767 -177.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.7 -43.79 94.32 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 110.678 -0.969 . . . . 0.0 110.678 -178.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.2 mt -59.06 -48.72 80.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.034 0.445 . . . . 0.0 110.506 -178.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 53.3 t -58.82 -43.24 87.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.168 -178.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -57.97 -43.0 86.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.681 -178.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.5 -42.77 99.67 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.407 -0.677 . . . . 0.0 111.407 -178.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 34.4 mt -63.94 -40.74 97.14 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.765 0.317 . . . . 0.0 111.403 -179.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 29.8 mt . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.687 -176.616 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 15.4 mt . . . . . 0 C--O 1.233 0.228 0 CA-C-O 119.406 -0.331 . . . . 0.0 110.123 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.05 139.96 15.51 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 C-N-CA 121.154 1.236 . . . . 0.0 111.145 174.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -97.12 125.83 44.47 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-O 118.782 -0.628 . . . . 0.0 109.97 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -77.79 154.9 30.57 Favored 'Trans proline' 0 N--CA 1.494 1.52 0 C-N-CA 121.415 1.41 . . . . 0.0 111.438 173.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -50.54 151.18 10.64 Favored 'Trans proline' 0 N--CA 1.496 1.647 0 C-N-CA 121.263 1.309 . . . . 0.0 111.747 178.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 79.5 mt -49.94 -25.83 3.62 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 -177.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -55.54 -38.49 69.35 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.904 0.383 . . . . 0.0 111.059 -177.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 33.3 t90 -61.81 -48.11 82.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.269 -176.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 37.6 tt0 -61.37 -48.2 82.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.073 0.463 . . . . 0.0 110.532 -177.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -59.86 -45.32 92.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 -177.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -58.76 -46.45 87.44 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.669 -176.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.53 -48.43 81.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.765 -177.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.104 -176.53 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.8 t . . . . . 0 N--CA 1.46 0.073 0 CA-C-O 120.892 0.377 . . . . 0.0 110.659 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.0 mm -60.09 -45.71 95.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.215 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.2 m -59.24 -45.66 90.57 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.024 0.44 . . . . 0.0 110.509 -177.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -59.38 -44.57 92.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.574 -178.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 44.5 ttm -58.26 -43.53 87.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.102 0.477 . . . . 0.0 110.463 -178.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -60.06 -49.5 77.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.299 -178.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 13.7 tp -61.32 -30.86 70.76 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.394 -179.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.85 -50.17 71.99 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.745 0.307 . . . . 0.0 110.619 178.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.44 -41.49 85.24 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.945 0.402 . . . . 0.0 110.392 178.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 95.5 mt -54.22 -52.95 33.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.659 178.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -53.3 -24.29 11.29 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -178.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -59.87 -33.52 71.93 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -177.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.5 mm -108.34 -40.69 4.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.787 0.327 . . . . 0.0 110.532 -176.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -114.78 84.94 10.89 Favored Pre-proline 0 CA--C 1.533 0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.713 -176.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -53.51 -22.97 23.33 Favored 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 121.522 1.482 . . . . 0.0 113.194 -178.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.4 p90 -97.98 22.06 9.84 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -175.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -101.81 121.23 41.7 Favored 'General case' 0 C--O 1.231 0.105 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 171.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 51.1 tptt -110.95 -38.15 5.18 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.761 0.315 . . . . 0.0 111.272 -173.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -130.02 144.82 51.54 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.808 -176.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 59.4 mt -98.7 129.21 49.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.83 173.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.1 t -90.46 -47.11 14.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 0.0 109.914 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -153.37 152.13 30.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.129 178.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.7 p -140.82 131.96 26.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.992 0.425 . . . . 0.0 110.775 178.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.9 t -107.02 129.18 54.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.901 177.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.3 m -54.41 -38.3 66.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.269 -172.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 -152.41 127.53 9.77 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.323 0.583 . . . . 0.0 111.91 -178.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 98.4 t -145.2 140.69 22.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.466 -178.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.41 149.83 50.38 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.159 -178.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -97.03 132.78 42.49 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.204 0.526 . . . . 0.0 111.723 -177.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -128.16 142.85 51.06 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.668 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.3 m -121.5 148.09 44.92 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 177.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -112.48 131.69 55.45 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-O 120.865 0.364 . . . . 0.0 110.357 177.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -102.01 113.78 27.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.775 176.332 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 85.6 p -68.56 -31.02 69.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.074 -177.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.2 m -62.6 -38.58 90.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.667 0.27 . . . . 0.0 110.928 -177.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -94.68 -21.41 18.79 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -178.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 69.58 45.66 0.78 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.463 0.649 . . . . 0.0 109.434 -177.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 -151.89 149.69 29.24 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.233 -177.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 82.7 m95 -86.98 142.46 27.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.199 176.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -123.78 126.29 46.21 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 175.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -75.51 140.35 42.73 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 178.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.8 p -92.29 170.72 9.57 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.144 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -84.37 12.43 6.77 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 178.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 40.4 t -104.39 106.48 20.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-O 120.969 0.414 . . . . 0.0 110.215 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -130.7 116.1 17.57 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 176.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.55 176.39 38.89 Favored Glycine 0 CA--C 1.521 0.443 0 C-N-CA 120.081 -1.056 . . . . 0.0 112.441 -169.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -80.22 136.63 36.51 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 175.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -101.8 125.31 48.44 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.293 -175.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -129.46 141.57 50.99 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.791 0.329 . . . . 0.0 110.712 177.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 67.9 mt -101.58 126.38 55.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 171.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 11.6 m-30 -108.57 138.05 45.51 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.892 0.377 . . . . 0.0 111.335 -177.261 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 61.9 t60 -111.6 143.25 42.78 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.871 173.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 13.4 tpt180 -142.22 147.71 36.97 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.884 177.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -86.9 28.18 0.93 Allowed 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.73 171.3 20.33 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.1 mp0 -63.99 124.38 85.01 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.003 -178.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -79.41 140.97 59.01 Favored 'Cis proline' 0 N--CA 1.497 1.685 0 CA-C-N 121.937 1.728 . . . . 0.0 111.926 -0.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -63.2 -44.26 95.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.941 -177.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -143.32 135.86 27.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.307 0.575 . . . . 0.0 110.837 -177.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.4 t -149.6 150.91 32.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.572 -177.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 57.7 mt -114.32 137.46 47.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 -178.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -131.94 142.16 49.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.581 -177.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.5 mt -120.05 129.41 75.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.247 0.546 . . . . 0.0 109.729 172.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -96.58 99.52 11.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.531 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.2 t-20 -71.23 105.45 3.45 Favored 'General case' 0 N--CA 1.462 0.151 0 O-C-N 123.642 0.589 . . . . 0.0 110.971 -175.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -73.1 -42.43 62.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.235 -171.052 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 60.4 mt -70.9 -45.21 64.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.624 -174.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 54.8 m-20 -95.11 -3.27 48.36 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -175.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.0 m 55.71 43.52 27.83 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 121.452 0.644 . . . . 0.0 110.452 177.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.6 m -125.16 148.87 48.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.52 -178.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.3 p -97.3 132.53 42.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.346 -179.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -123.59 122.1 37.29 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.8 p -125.54 147.68 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-O 120.751 0.31 . . . . 0.0 111.237 -178.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -149.77 126.55 5.34 Favored Pre-proline 0 CA--C 1.537 0.473 0 CA-C-O 118.665 -0.684 . . . . 0.0 110.213 174.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -75.27 150.94 37.71 Favored 'Trans proline' 0 N--CA 1.498 1.765 0 C-N-CA 121.46 1.44 . . . . 0.0 112.265 178.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 67.0 mt -90.65 138.92 18.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.929 0.395 . . . . 0.0 110.302 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.4 p -132.1 155.65 47.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.706 177.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -94.04 36.68 3.65 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.002 -178.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.9 m -111.12 -22.97 11.17 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 173.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.7 mt -69.13 146.44 52.51 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 120.898 0.38 . . . . 0.0 111.373 -176.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.3 tt0 -115.78 135.93 53.54 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.662 175.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.1 mt -112.03 158.58 19.38 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.07 0.462 . . . . 0.0 111.058 -176.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -147.87 140.22 24.4 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.957 -0.756 . . . . 0.0 108.957 177.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.1 t -106.94 109.34 21.21 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.386 -177.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -106.83 103.68 48.25 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 169.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.1 145.25 78.48 Favored 'Trans proline' 0 N--CA 1.498 1.779 0 CA-C-N 120.391 1.175 . . . . 0.0 112.037 -170.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -92.61 17.53 41.6 Favored 'Cis proline' 0 N--CA 1.499 1.84 0 CA-C-N 120.893 1.355 . . . . 0.0 113.346 -3.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -104.89 162.11 13.61 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 110.337 -0.246 . . . . 0.0 110.337 -177.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 32.8 tp -115.72 133.48 55.99 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 122.062 -0.399 . . . . 0.0 111.177 -179.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.5 tp -122.53 140.42 52.79 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.252 -175.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -142.89 154.96 44.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.768 0.318 . . . . 0.0 110.492 176.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.8 mtm105 -101.96 146.65 27.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.71 -178.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -127.14 163.4 23.9 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.668 0.746 . . . . 0.0 111.414 -177.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 31.6 mp0 -48.33 147.17 2.44 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.112 -177.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 64.31 30.96 13.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.118 -0.946 . . . . 0.0 112.176 179.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 48.9 m 67.29 35.24 4.48 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.901 0.381 . . . . 0.0 111.631 165.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -99.82 151.36 21.37 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 178.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 76.4 mt -114.71 126.51 72.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -178.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -137.21 149.72 47.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.13 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -147.39 169.42 28.34 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.001 -175.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -125.16 136.81 53.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.364 -0.418 . . . . 0.0 110.415 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 46.2 t90 -104.47 125.17 50.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.509 176.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -112.22 140.91 46.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.733 -177.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -51.49 -40.78 60.21 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.81 179.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -129.06 136.55 50.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.671 0.272 . . . . 0.0 110.462 -179.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.2 p -63.14 -41.52 99.3 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.309 -177.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -60.38 -44.81 95.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.514 0.673 . . . . 0.0 109.985 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -55.98 -43.48 77.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.206 178.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 51.6 t -59.35 -41.46 89.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.527 177.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -58.65 -44.59 90.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.618 -176.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -60.56 -49.33 77.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.748 -177.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 30.4 mm -58.29 -45.91 89.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.099 0.476 . . . . 0.0 110.077 -178.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 78.0 p -59.99 -43.5 95.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.702 -177.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.66 -43.27 94.44 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.68 -0.968 . . . . 0.0 110.68 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 10.6 mt -59.83 -49.8 76.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.017 0.436 . . . . 0.0 110.686 -178.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 59.0 t -59.01 -42.67 86.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.148 -178.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -58.45 -43.03 88.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.861 0.362 . . . . 0.0 110.639 -178.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.25 -40.58 98.78 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.335 -0.706 . . . . 0.0 111.335 -179.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 34.8 mt -63.08 -42.97 99.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.794 0.33 . . . . 0.0 111.077 178.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 40.5 mt . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.435 -177.061 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 13.9 mt . . . . . 0 CA--C 1.531 0.231 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -79.14 139.9 15.32 Favored 'Trans proline' 0 N--CA 1.491 1.361 0 C-N-CA 121.182 1.255 . . . . 0.0 111.221 174.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -97.06 125.77 44.78 Favored Pre-proline 0 CA--C 1.534 0.363 0 CA-C-O 118.721 -0.657 . . . . 0.0 109.997 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -72.57 155.43 54.76 Favored 'Trans proline' 0 N--CA 1.496 1.664 0 C-N-CA 121.383 1.389 . . . . 0.0 111.681 173.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.05 157.0 6.63 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 121.31 1.34 . . . . 0.0 111.613 178.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.3 tp -49.9 -29.94 9.18 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -177.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 56.8 t80 -55.15 -37.7 67.3 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.833 0.349 . . . . 0.0 111.207 -177.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 20.3 t90 -61.11 -48.14 83.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.256 -177.059 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -62.02 -47.83 83.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.007 0.432 . . . . 0.0 110.531 -177.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -59.33 -44.59 92.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.838 -177.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -58.99 -46.59 87.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.699 -176.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.09 -47.88 84.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.721 -177.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.006 -176.725 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 87.0 p . . . . . 0 N--CA 1.458 -0.042 0 CA-C-O 120.937 0.398 . . . . 0.0 110.377 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mm -60.19 -45.2 96.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.215 -178.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.8 m -59.3 -44.45 92.52 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.525 -177.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -59.31 -45.99 89.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.542 -178.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.5 mtt -58.21 -44.18 88.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.126 0.489 . . . . 0.0 110.428 -178.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -60.09 -48.24 82.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.292 -178.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.8 tp -60.83 -32.35 71.74 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.193 -178.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.7 -50.2 72.09 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.668 0.27 . . . . 0.0 110.636 178.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.55 -41.91 86.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.031 0.443 . . . . 0.0 110.418 179.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 97.7 mt -54.17 -52.96 32.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.654 178.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -53.35 -23.42 9.37 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -59.53 -33.83 71.88 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -177.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.7 mm -108.5 -42.43 5.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.823 0.344 . . . . 0.0 110.173 -177.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -117.09 77.85 9.46 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.18 -177.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -55.04 -21.07 25.63 Favored 'Trans proline' 0 N--CA 1.498 1.753 0 C-N-CA 121.516 1.477 . . . . 0.0 113.529 -175.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.1 p90 -90.87 9.96 28.21 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.574 0.954 . . . . 0.0 113.574 -174.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.53 127.87 33.66 Favored 'General case' 0 C--O 1.231 0.123 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 175.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 69.1 tttt -97.46 -40.47 8.66 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.651 -176.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -157.93 155.81 30.18 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.679 -0.408 . . . . 0.0 111.38 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 37.0 mt -89.79 140.16 16.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.951 177.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.6 t -92.74 -47.13 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.83 176.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -156.49 158.97 38.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.884 178.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.5 p -143.24 134.58 26.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.162 0.506 . . . . 0.0 111.323 -179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 24.1 t -109.58 124.69 51.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.598 176.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.0 t -54.36 -38.88 66.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.302 -172.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -149.11 125.85 11.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.205 0.526 . . . . 0.0 111.81 -178.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 87.3 t -145.18 139.28 22.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 114.986 -1.006 . . . . 0.0 109.506 -177.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.04 149.83 50.7 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.041 -178.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -96.61 133.44 41.11 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.379 0.609 . . . . 0.0 111.884 -176.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -127.79 139.87 52.4 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.222 177.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 93.8 m -122.73 146.15 47.76 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -108.22 130.6 55.14 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.862 0.363 . . . . 0.0 110.317 176.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 29.9 t-20 -101.54 116.24 32.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.998 -0.547 . . . . 0.0 109.983 177.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.8 m -68.13 -33.05 73.77 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.902 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.0 p -62.23 -37.02 83.8 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.178 -177.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -95.56 -21.41 18.28 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -178.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 69.0 45.29 0.93 Allowed 'General case' 0 C--O 1.231 0.108 0 CA-C-O 121.424 0.631 . . . . 0.0 109.489 -177.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 32.0 tp10 -156.05 152.37 27.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.013 -177.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 85.2 m95 -86.78 143.67 27.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.296 176.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.7 tp10 -125.0 129.42 50.29 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 176.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 20.4 pttp -75.11 138.86 42.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.127 177.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.5 p -92.4 167.57 11.89 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.16 -178.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -82.94 12.29 5.11 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 178.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.1 t -101.29 106.53 19.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-O 120.962 0.41 . . . . 0.0 110.289 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -130.7 113.87 14.69 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 176.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.67 176.57 38.97 Favored Glycine 0 CA--C 1.52 0.391 0 C-N-CA 120.221 -0.99 . . . . 0.0 112.322 -169.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -80.91 134.93 35.82 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 175.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -98.51 129.64 45.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.849 0.356 . . . . 0.0 110.201 -176.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -132.96 143.53 49.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.237 177.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 69.0 mt -101.58 128.65 53.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 172.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 12.3 m-30 -108.58 135.78 49.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.843 0.354 . . . . 0.0 111.183 -175.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 50.1 t60 -118.34 143.26 46.75 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.238 176.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 60.0 ttt180 -141.97 147.92 37.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.147 178.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -86.83 28.07 0.93 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 178.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -159.1 167.36 29.4 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 -63.94 128.47 92.99 Favored Pre-proline 0 CA--C 1.538 0.509 0 CA-C-O 118.436 -0.793 . . . . 0.0 110.002 -178.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -74.94 140.93 70.08 Favored 'Cis proline' 0 N--CA 1.497 1.722 0 CA-C-N 121.943 1.729 . . . . 0.0 111.753 -1.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -65.45 -47.06 77.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.085 -177.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -142.69 137.37 29.83 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.431 0.634 . . . . 0.0 110.936 -176.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.0 t -151.14 152.28 33.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.45 -177.244 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 41.8 mt -107.04 141.61 21.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -131.74 141.93 49.65 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.371 -177.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.3 mt -128.38 131.42 69.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.25 0.548 . . . . 0.0 110.237 174.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -98.76 99.47 10.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 114.957 -1.019 . . . . 0.0 109.626 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -73.74 105.88 5.23 Favored 'General case' 0 N--CA 1.463 0.188 0 O-C-N 123.679 0.612 . . . . 0.0 110.717 -176.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 -73.64 -41.3 62.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.587 -170.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 66.5 mt -72.17 -45.21 61.36 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.551 -174.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 57.5 m-20 -95.07 -3.32 48.41 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.702 1.001 . . . . 0.0 113.702 -175.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 10.9 m 54.72 43.53 29.97 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 121.516 0.674 . . . . 0.0 110.748 176.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 32.6 m -126.99 145.21 50.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.511 -178.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 13.6 p -90.75 130.91 36.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.25 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -119.41 122.32 41.5 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 175.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 34.6 t -125.4 145.14 33.26 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-O 120.614 0.245 . . . . 0.0 110.623 -177.202 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -148.68 126.39 5.73 Favored Pre-proline 0 CA--C 1.538 0.501 0 CA-C-O 118.747 -0.644 . . . . 0.0 110.498 174.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -75.27 150.91 37.69 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 121.621 1.547 . . . . 0.0 111.891 175.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 66.4 mt -93.68 120.35 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.156 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.416 179.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 68.3 p -99.33 154.25 18.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.785 175.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -93.7 26.49 16.01 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.721 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.5 t -111.04 -12.86 14.16 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.411 0.522 . . . . 0.0 112.411 174.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 78.0 mt -67.52 146.14 54.23 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.072 0.463 . . . . 0.0 111.262 -176.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.1 tt0 -117.62 135.85 53.7 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.801 176.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 63.0 mt -112.18 155.56 23.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.923 0.392 . . . . 0.0 110.8 -177.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -147.55 144.16 28.31 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.079 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.0 t -99.48 109.09 21.68 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.668 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -106.77 103.78 48.5 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 171.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.18 143.52 44.31 Favored 'Trans proline' 0 N--CA 1.496 1.671 0 CA-C-N 120.527 1.224 . . . . 0.0 112.329 -169.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -90.4 14.93 48.91 Favored 'Cis proline' 0 N--CA 1.499 1.842 0 CA-C-N 121.05 1.411 . . . . 0.0 113.481 -4.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -95.46 170.67 9.2 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 122.419 0.288 . . . . 0.0 110.776 -177.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 52.4 tp -116.32 133.47 55.99 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 174.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 11.1 tp -125.09 140.51 52.82 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.392 -173.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 48.0 p90 -142.97 150.08 39.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.943 0.402 . . . . 0.0 110.523 175.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 26.5 mtm180 -102.37 146.9 27.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.26 -175.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -128.46 157.17 41.85 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.901 0.857 . . . . 0.0 111.367 -179.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 54.6 tt0 -49.57 150.05 2.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.724 -177.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 64.56 30.95 12.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.241 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 42.1 t 68.88 35.27 2.97 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.005 0.431 . . . . 0.0 111.645 164.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -98.96 140.61 32.85 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 177.531 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 78.9 mt -114.75 124.05 71.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -177.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -135.14 146.1 48.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.423 -178.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -144.33 169.35 26.4 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 120.888 -0.673 . . . . 0.0 111.648 -177.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -126.16 142.81 51.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.027 0.441 . . . . 0.0 110.752 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 73.7 t90 -106.31 125.01 50.47 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.443 174.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -111.29 139.69 46.48 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 123.281 0.363 . . . . 0.0 110.611 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -51.74 -37.53 51.46 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.678 179.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -132.54 136.06 46.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.42 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 84.5 p -62.8 -41.62 99.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.303 -177.507 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -59.85 -44.02 94.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.509 0.671 . . . . 0.0 110.016 178.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -56.51 -44.67 80.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.067 178.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 50.2 t -59.2 -39.72 83.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.519 177.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -58.89 -45.94 89.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.852 0.358 . . . . 0.0 110.642 -177.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 22.8 ttp-105 -61.33 -50.16 74.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.791 -177.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 30.2 mm -58.56 -44.16 88.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.051 0.453 . . . . 0.0 110.0 -178.19 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 59.7 p -59.85 -43.99 94.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.698 -177.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.56 -43.75 94.08 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 -178.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 12.0 mt -58.97 -48.5 81.31 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.05 0.453 . . . . 0.0 110.598 -178.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 54.5 t -59.07 -44.3 91.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.067 -178.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -57.39 -42.14 81.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.63 -178.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.9 -45.25 96.56 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -179.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 62.1 mt -58.65 -42.19 87.81 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.926 0.393 . . . . 0.0 110.642 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 88.0 mt . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.867 -178.988 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 19.9 mt . . . . . 0 C--O 1.234 0.262 0 CA-C-O 118.493 -0.765 . . . . 0.0 109.613 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -79.15 139.63 15.13 Favored 'Trans proline' 0 N--CA 1.493 1.455 0 CA-C-N 120.394 1.176 . . . . 0.0 111.193 174.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 6.7 mtmp? -97.28 125.99 43.51 Favored Pre-proline 0 CA--C 1.535 0.403 0 CA-C-O 118.343 -0.837 . . . . 0.0 110.119 178.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -61.86 165.34 14.3 Favored 'Trans proline' 0 N--CA 1.497 1.722 0 CA-C-N 120.657 1.27 . . . . 0.0 111.655 177.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -49.27 156.98 2.2 Favored 'Trans proline' 0 N--CA 1.497 1.679 0 C-N-CA 121.395 1.397 . . . . 0.0 111.866 178.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 6.2 mp -50.17 -29.19 8.74 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -176.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -56.4 -35.79 68.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.733 0.301 . . . . 0.0 111.429 -176.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 54.9 t90 -60.77 -48.14 83.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.955 0.407 . . . . 0.0 110.465 -176.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -65.23 -48.11 74.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.921 0.391 . . . . 0.0 110.804 -178.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -57.81 -44.39 86.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.964 0.412 . . . . 0.0 110.758 -176.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -59.19 -47.9 83.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.398 -177.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -57.82 -45.27 86.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.684 -177.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.319 -176.427 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.2 p . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.976 0.417 . . . . 0.0 110.427 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.2 mm -60.18 -44.44 95.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.198 -179.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.4 m -59.05 -44.71 91.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.991 0.424 . . . . 0.0 110.534 -177.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -59.36 -47.12 86.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.4 -178.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 87.2 mtp -58.29 -42.49 86.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.127 0.489 . . . . 0.0 110.41 -178.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -59.88 -48.5 81.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.298 -178.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.7 tp -60.4 -33.43 72.47 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.127 -178.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.5 -50.03 73.03 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.65 0.262 . . . . 0.0 110.688 179.041 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.11 -41.18 87.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.952 0.406 . . . . 0.0 110.565 179.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 96.8 mt -54.19 -52.88 33.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.618 178.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -53.61 -24.06 12.86 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -177.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.7 mtpt -60.25 -33.07 71.79 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -177.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 45.8 mm -109.12 -41.25 4.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.802 0.334 . . . . 0.0 110.407 -176.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -116.27 77.82 7.66 Favored Pre-proline 0 CA--C 1.535 0.392 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.311 -177.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -53.72 -20.46 17.06 Favored 'Trans proline' 0 N--CA 1.498 1.784 0 C-N-CA 121.469 1.446 . . . . 0.0 113.427 -176.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.2 p90 -94.42 17.63 12.66 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -174.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -92.45 127.5 37.96 Favored 'General case' 0 C--O 1.232 0.133 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 173.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -101.57 -40.61 6.94 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.75 -176.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -150.59 156.37 41.25 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.976 0.417 . . . . 0.0 111.336 -179.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 58.1 mt -93.09 136.5 24.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.174 177.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.1 t -88.44 -47.1 15.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.753 176.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -152.34 157.01 40.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.865 177.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.4 p -143.29 131.98 22.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.988 0.423 . . . . 0.0 111.056 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.6 t -109.13 126.17 52.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.706 177.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.2 t -54.47 -39.08 67.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.243 -171.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -150.21 127.04 11.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.242 0.544 . . . . 0.0 111.722 -178.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 94.6 t -145.14 140.5 22.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.437 -177.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.46 149.81 51.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.14 -177.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -97.91 132.08 43.81 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.249 0.547 . . . . 0.0 111.588 -176.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -125.61 142.31 51.57 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.759 179.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 80.4 m -120.81 148.14 44.41 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.184 -0.672 . . . . 0.0 109.184 177.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -109.48 131.97 54.56 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.975 0.417 . . . . 0.0 110.483 176.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -104.25 116.15 31.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.969 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 85.1 p -69.85 -31.03 68.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.137 -176.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -61.9 -38.1 87.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.662 0.267 . . . . 0.0 110.914 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -95.49 -21.42 18.32 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -178.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 28.3 t30 69.16 43.67 1.07 Allowed 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.366 0.603 . . . . 0.0 109.739 -177.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -151.07 164.52 36.27 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.99 -177.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 85.0 m95 -96.01 141.55 29.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.468 178.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -123.88 127.46 48.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.945 177.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.9 ttpp -75.1 139.96 43.12 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 62.3 p -92.34 173.35 7.85 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.088 -179.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -84.83 12.6 7.07 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 178.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.7 t -104.28 106.48 20.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 121.0 0.428 . . . . 0.0 110.311 179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -130.47 115.03 16.26 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 176.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.63 176.51 38.95 Favored Glycine 0 CA--C 1.52 0.367 0 C-N-CA 120.08 -1.057 . . . . 0.0 112.182 -169.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -81.36 136.51 35.74 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 175.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -99.15 129.91 45.43 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.085 -176.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -133.46 143.13 48.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.287 177.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 69.9 mt -101.65 128.14 54.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 172.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -108.42 134.39 51.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.836 0.351 . . . . 0.0 111.136 -174.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 59.6 t60 -119.68 140.09 51.2 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.19 176.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.3 tpt180 -142.15 149.84 40.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.709 177.056 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -86.85 28.12 0.93 Allowed 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.79 170.19 22.93 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -64.13 125.98 89.26 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-O 118.46 -0.781 . . . . 0.0 110.005 -178.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.65 140.93 65.37 Favored 'Cis proline' 0 N--CA 1.497 1.682 0 CA-C-N 121.844 1.694 . . . . 0.0 111.833 -1.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -65.7 -47.71 74.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.059 -177.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -142.15 135.38 28.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.458 0.647 . . . . 0.0 110.926 -176.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.0 t -150.93 152.36 33.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.413 -177.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.2 mt -107.93 140.13 27.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -131.73 142.0 49.67 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.625 -177.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.0 mt -127.89 130.9 70.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.238 0.542 . . . . 0.0 110.053 173.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -99.21 99.61 10.61 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.753 -179.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -71.69 105.07 3.56 Favored 'General case' 0 C--N 1.332 -0.183 0 O-C-N 123.757 0.661 . . . . 0.0 110.672 -177.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -72.52 -42.05 65.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.5 -170.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.8 mt -71.95 -45.27 61.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.702 -174.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 54.7 m-20 -95.02 -3.35 48.52 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -175.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.9 m 54.94 43.6 29.65 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.399 0.619 . . . . 0.0 110.648 177.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.7 m -125.35 141.59 51.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.531 -178.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 14.8 p -88.15 130.18 35.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.291 -179.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -118.85 122.29 42.0 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 175.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 30.3 t -125.5 145.75 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 120.678 0.275 . . . . 0.0 110.532 -177.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -149.14 126.36 5.52 Favored Pre-proline 0 CA--C 1.538 0.488 0 CA-C-O 118.698 -0.667 . . . . 0.0 110.561 174.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -75.41 150.95 37.12 Favored 'Trans proline' 0 N--CA 1.498 1.757 0 C-N-CA 121.463 1.442 . . . . 0.0 112.305 177.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 69.2 mt -92.65 133.93 32.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 CA-C-O 120.977 0.418 . . . . 0.0 110.249 178.122 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.0 p -132.14 158.48 41.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.775 177.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -94.68 35.03 4.4 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.026 -178.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.7 t -108.47 -23.31 11.92 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 173.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.5 mt -68.36 148.58 50.5 Favored 'General case' 0 C--O 1.23 0.077 0 CA-C-O 120.922 0.391 . . . . 0.0 111.324 -176.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.5 tt0 -118.16 135.84 53.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.784 176.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.4 mt -113.9 157.93 21.74 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.075 0.464 . . . . 0.0 111.0 -176.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -148.14 139.54 23.56 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.2 t -97.33 109.17 21.98 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.793 -179.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -106.71 103.74 48.16 Favored Pre-proline 0 C--N 1.329 -0.321 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 172.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -71.18 139.61 35.74 Favored 'Trans proline' 0 N--CA 1.496 1.676 0 CA-C-N 120.619 1.257 . . . . 0.0 112.002 -171.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -89.11 9.0 65.74 Favored 'Cis proline' 0 N--CA 1.501 1.943 0 CA-C-N 121.213 1.469 . . . . 0.0 113.764 -4.282 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -84.62 170.11 13.69 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.7 0.286 . . . . 0.0 111.223 -177.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 53.7 tp -118.66 131.75 56.17 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 170.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 11.6 tp -123.63 139.56 53.87 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 110.408 -0.219 . . . . 0.0 110.408 -174.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 11.7 p90 -144.49 151.3 38.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.938 0.399 . . . . 0.0 110.651 176.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.4 mtm180 -102.13 148.93 24.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.023 -176.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -130.91 165.65 22.63 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.841 0.829 . . . . 0.0 111.666 -178.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -48.39 148.17 2.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.092 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 71.9 mtt85 63.17 30.86 15.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.212 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 52.1 m 66.55 35.18 5.57 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.921 0.391 . . . . 0.0 111.598 166.108 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -98.16 149.45 22.52 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 178.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 82.4 mt -117.89 127.84 75.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 121.064 0.459 . . . . 0.0 109.824 -177.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -135.99 150.38 49.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.382 177.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -142.25 169.36 25.43 Favored Glycine 0 CA--C 1.522 0.53 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 -176.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -125.38 139.45 53.66 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.847 0.356 . . . . 0.0 110.622 -179.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 7.4 t90 -107.75 127.55 53.78 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.57 175.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -116.14 144.2 44.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.832 0.349 . . . . 0.0 110.682 -179.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -51.57 -37.49 49.98 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.626 178.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -134.06 135.92 43.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.846 0.355 . . . . 0.0 110.531 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.8 m -61.33 -42.01 97.98 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.098 -177.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -59.46 -43.5 93.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.401 0.62 . . . . 0.0 110.081 178.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -56.31 -44.84 80.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.084 178.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 42.9 t -59.94 -39.85 86.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.708 178.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -59.28 -45.31 91.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.771 0.319 . . . . 0.0 110.608 -177.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -60.08 -49.13 78.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.518 -177.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 35.3 mm -58.43 -45.49 89.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.047 0.451 . . . . 0.0 110.094 -178.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 68.3 p -59.72 -43.34 94.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.756 -177.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.74 -44.36 94.17 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 110.66 -0.976 . . . . 0.0 110.66 -179.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 10.8 mt -58.77 -48.29 81.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.081 0.467 . . . . 0.0 110.503 -178.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 52.0 t -58.91 -43.78 89.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.171 -178.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -57.46 -42.41 82.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.635 -178.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.32 -43.16 99.47 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 78.2 mt -61.79 -41.37 97.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.833 0.349 . . . . 0.0 111.044 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 27.6 mt . . . . . 0 C--N 1.327 -0.373 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.682 -177.263 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 10.8 mt . . . . . 0 C--O 1.233 0.218 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -79.14 139.73 15.2 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 C-N-CA 121.101 1.201 . . . . 0.0 111.241 175.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -97.3 125.96 43.59 Favored Pre-proline 0 CA--C 1.537 0.448 0 CA-C-O 118.474 -0.774 . . . . 0.0 109.915 178.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -78.17 169.05 20.91 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 121.272 1.315 . . . . 0.0 111.792 176.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -62.0 156.59 48.56 Favored 'Trans proline' 0 N--CA 1.495 1.616 0 C-N-CA 121.261 1.308 . . . . 0.0 111.41 177.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.9 tp -50.04 -28.55 7.22 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.451 0.538 . . . . 0.0 112.451 -176.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 67.9 t80 -54.84 -37.31 66.02 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.773 0.32 . . . . 0.0 111.304 -176.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 46.1 t90 -61.61 -48.07 82.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.411 -176.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -61.88 -48.98 78.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.025 0.441 . . . . 0.0 110.41 -177.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -58.92 -45.13 91.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.879 -176.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -59.28 -47.03 86.89 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.651 -176.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.23 -47.21 86.95 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.779 -177.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.522 -173.873 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 85.8 p . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.988 0.423 . . . . 0.0 110.558 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.9 mm -60.43 -44.47 96.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.193 -178.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 35.2 m -59.41 -45.54 91.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.931 0.396 . . . . 0.0 110.499 -177.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -59.77 -45.42 92.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.553 -178.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 44.7 ttm -58.27 -43.04 87.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.049 0.452 . . . . 0.0 110.382 -178.34 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -60.5 -49.62 76.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.348 -178.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 13.7 tp -61.52 -30.67 70.78 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.412 -178.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.12 -50.12 71.75 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.621 0.248 . . . . 0.0 110.527 178.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.86 -41.05 86.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.976 0.417 . . . . 0.0 110.565 178.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 95.7 mt -54.21 -52.98 32.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.643 178.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 76.7 mttt -55.08 -26.8 40.32 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -177.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -61.98 -29.92 70.58 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 -177.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.7 mm -109.76 -40.49 4.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.699 0.285 . . . . 0.0 110.391 -176.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -115.37 83.23 10.28 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.241 -178.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -54.22 -21.39 22.39 Favored 'Trans proline' 0 N--CA 1.498 1.751 0 C-N-CA 121.444 1.429 . . . . 0.0 113.549 -175.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 34.7 p90 -97.29 20.52 11.38 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -175.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -102.89 130.87 50.07 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 173.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 55.5 tttm -119.74 -35.19 3.57 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.625 0.25 . . . . 0.0 111.571 -175.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 85.4 tt0 -128.94 144.6 51.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.852 0.358 . . . . 0.0 110.585 -177.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 58.3 mt -99.04 131.02 47.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.803 173.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.3 t -90.42 -47.19 14.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.375 -0.375 . . . . 0.0 109.992 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -156.95 157.08 34.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.951 178.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.9 p -142.71 132.0 23.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.224 0.535 . . . . 0.0 111.293 -179.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.4 t -105.41 123.73 48.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.526 176.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 88.1 p -53.97 -37.16 63.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.455 -172.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -151.1 126.27 9.91 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.128 0.49 . . . . 0.0 111.449 -179.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 99.0 t -145.2 136.53 20.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.671 -177.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -127.47 149.85 49.92 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.966 -178.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -99.26 132.03 44.87 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-O 121.29 0.567 . . . . 0.0 111.931 -176.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -126.21 141.62 51.85 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.348 178.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.5 m -122.06 145.0 48.57 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 177.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -108.3 131.94 54.21 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.929 0.395 . . . . 0.0 110.451 176.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -102.99 114.34 28.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.858 176.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.4 m -67.86 -32.37 72.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.026 -177.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -62.32 -37.49 85.78 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.665 0.269 . . . . 0.0 111.129 -177.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -95.09 -21.48 18.52 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 32.0 t30 69.17 46.03 0.83 Allowed 'General case' 0 C--O 1.231 0.11 0 CA-C-O 121.505 0.669 . . . . 0.0 109.441 -177.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 72.7 tt0 -155.43 152.72 29.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.865 -177.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -89.34 143.76 26.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.387 177.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -124.35 128.53 49.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.832 176.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 26.4 pttm -75.45 140.16 42.71 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.031 178.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 52.5 p -92.3 170.21 9.97 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.111 -178.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -83.83 12.58 5.85 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 177.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.7 t -104.07 106.49 20.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.067 0.46 . . . . 0.0 110.281 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -132.38 115.79 16.03 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 176.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.41 38.97 Favored Glycine 0 CA--C 1.519 0.341 0 C-N-CA 120.153 -1.022 . . . . 0.0 112.5 -169.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -81.42 133.42 35.41 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 174.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -98.46 128.03 44.65 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -175.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -132.43 142.66 49.35 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.353 177.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 69.6 mt -101.64 127.94 54.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 171.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 15.6 m-30 -108.47 135.55 49.56 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.812 0.339 . . . . 0.0 111.242 -176.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 37.1 t60 -114.9 143.26 45.42 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.935 173.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.5 tpt85 -142.1 148.94 39.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.456 . . . . 0.0 109.986 176.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -86.87 28.11 0.93 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.29 159.27 37.38 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -63.88 134.46 95.92 Favored Pre-proline 0 CA--C 1.537 0.475 0 CA-C-O 118.651 -0.69 . . . . 0.0 110.141 -175.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -67.43 140.81 54.57 Favored 'Cis proline' 0 N--CA 1.498 1.779 0 CA-C-N 121.603 1.608 . . . . 0.0 111.371 -3.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -68.54 -47.83 65.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.154 -177.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -142.57 135.61 28.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.322 0.582 . . . . 0.0 110.84 -177.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 5.2 t -149.82 152.2 34.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.35 -176.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 56.4 mt -110.45 139.51 33.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.596 -179.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -131.75 142.12 49.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.723 -176.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.5 mt -123.15 127.1 74.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.144 0.497 . . . . 0.0 109.783 172.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -93.13 99.54 12.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.505 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -73.4 105.52 4.81 Favored 'General case' 0 C--N 1.332 -0.189 0 O-C-N 123.818 0.699 . . . . 0.0 110.881 -175.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 69.3 mtm180 -73.04 -42.43 63.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.602 -170.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.5 mt -72.94 -45.08 60.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.63 -174.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -94.97 -3.38 48.6 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -175.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 72.0 p 50.8 43.58 28.2 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.429 0.633 . . . . 0.0 111.238 177.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 35.5 m -128.27 131.35 48.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.408 -179.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 77.1 p -74.43 130.02 38.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.429 -179.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -117.03 122.2 43.52 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 173.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 39.6 t -125.56 146.8 30.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 120.852 0.358 . . . . 0.0 110.802 -177.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -149.51 126.45 5.41 Favored Pre-proline 0 CA--C 1.538 0.485 0 CA-C-O 118.723 -0.656 . . . . 0.0 110.354 174.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -75.3 150.96 37.62 Favored 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 121.443 1.429 . . . . 0.0 112.033 177.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 65.2 mt -87.12 131.95 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.138 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.586 -179.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.7 p -132.16 157.98 42.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.599 176.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -108.83 38.91 3.1 Favored Glycine 0 CA--C 1.523 0.592 0 C-N-CA 121.115 -0.564 . . . . 0.0 111.856 -177.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 10.5 t -103.68 -30.07 10.67 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.767 -0.217 . . . . 0.0 111.156 172.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.23 149.0 44.97 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.828 0.347 . . . . 0.0 111.201 -176.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -106.52 141.71 37.37 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 175.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 66.9 mt -111.8 159.75 18.0 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.789 0.328 . . . . 0.0 110.504 -178.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -151.12 145.19 25.29 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 177.003 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 26.2 t -102.51 109.31 20.9 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.512 178.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -106.81 103.76 48.53 Favored Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 173.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -69.86 140.63 42.78 Favored 'Trans proline' 0 N--CA 1.497 1.7 0 CA-C-N 120.496 1.213 . . . . 0.0 112.074 -170.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -88.95 9.46 64.52 Favored 'Cis proline' 0 N--CA 1.5 1.905 0 CA-C-N 121.193 1.462 . . . . 0.0 113.697 -4.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -86.75 167.79 14.11 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.798 0.333 . . . . 0.0 111.109 -177.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 58.1 tp -115.75 133.97 55.49 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 170.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 12.4 tp -128.4 140.14 52.0 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.557 0.218 . . . . 0.0 110.469 -173.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 19.8 p90 -146.94 165.1 30.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.918 0.389 . . . . 0.0 110.592 176.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 37.8 mtt-85 -101.74 148.27 25.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.158 -178.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -128.83 163.94 24.12 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.867 0.841 . . . . 0.0 111.55 -177.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 32.0 mp0 -49.31 147.77 2.98 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.873 -176.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 79.6 mtm180 63.38 30.97 15.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.119 -0.946 . . . . 0.0 112.207 178.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 50.3 m 67.36 35.22 4.42 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.916 0.389 . . . . 0.0 111.535 167.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -101.49 152.71 20.44 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 179.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 77.1 mt -111.07 129.6 66.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -179.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -137.96 149.39 46.1 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.897 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.96 168.85 26.37 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 111.274 -0.73 . . . . 0.0 111.274 -177.275 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -125.29 138.61 54.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.815 0.341 . . . . 0.0 110.602 -179.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 7.6 t90 -104.12 122.61 45.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.536 175.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -112.51 143.02 44.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.771 0.319 . . . . 0.0 110.554 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 72.3 t80 -50.7 -35.87 33.29 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.702 178.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.9 t-20 -136.27 134.92 38.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.762 0.315 . . . . 0.0 110.462 179.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.6 t -61.68 -42.07 98.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.089 -177.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 -60.29 -43.54 96.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.375 0.607 . . . . 0.0 110.158 179.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 49.3 tt0 -56.62 -45.88 81.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.604 0.716 . . . . 0.0 110.0 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 38.4 t -60.56 -38.29 84.06 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.854 178.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -58.85 -46.22 88.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.923 0.392 . . . . 0.0 110.44 -177.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 51.2 mtp180 -58.98 -47.63 84.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.073 0.463 . . . . 0.0 110.552 -178.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 29.1 mm -58.23 -45.64 88.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.085 -179.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.0 p -59.29 -42.98 92.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.72 -177.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.6 -44.99 93.71 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.614 -0.995 . . . . 0.0 110.614 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 10.4 mt -58.67 -49.1 78.78 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.181 0.515 . . . . 0.0 110.491 -178.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 49.3 t -58.53 -41.42 81.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.265 -178.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -58.5 -43.76 89.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.89 0.376 . . . . 0.0 110.593 -179.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -60.75 -40.78 98.58 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.262 -0.735 . . . . 0.0 111.262 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.9 mt -65.69 -43.06 90.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.645 0.26 . . . . 0.0 111.414 179.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 18.1 mt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.258 -176.388 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 8.3 mt . . . . . 0 CA--C 1.532 0.283 0 CA-C-O 118.55 -0.738 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -79.13 139.57 15.12 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 CA-C-N 120.211 1.111 . . . . 0.0 111.237 174.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -97.31 125.89 43.84 Favored Pre-proline 0 CA--C 1.536 0.436 0 CA-C-O 118.473 -0.775 . . . . 0.0 110.279 178.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -67.41 160.37 48.09 Favored 'Trans proline' 0 N--CA 1.497 1.712 0 C-N-CA 121.165 1.243 . . . . 0.0 111.627 175.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.82 156.86 2.94 Favored 'Trans proline' 0 N--CA 1.497 1.686 0 C-N-CA 121.288 1.326 . . . . 0.0 111.827 178.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.4 tp -50.04 -29.15 8.19 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -176.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 64.9 t80 -54.94 -38.27 67.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.932 0.396 . . . . 0.0 111.164 -177.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 35.7 t90 -60.6 -48.2 82.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.206 -177.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -61.48 -48.18 82.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.965 0.412 . . . . 0.0 110.67 -176.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -60.0 -46.11 90.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.819 -176.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -58.08 -46.31 85.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.693 -175.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -61.56 -51.36 68.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.904 -176.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.343 -174.846 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 24.7 m . . . . . 0 CA--C 1.527 0.066 0 CA-C-O 120.823 0.344 . . . . 0.0 110.857 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.4 mm -59.52 -46.85 92.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.991 0.424 . . . . 0.0 110.041 -179.005 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.4 m -58.68 -44.38 90.21 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.15 0.5 . . . . 0.0 110.449 -178.339 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -59.2 -45.32 91.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.644 -178.571 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 89.6 mtp -58.29 -42.84 87.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.996 0.426 . . . . 0.0 110.463 -178.221 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -59.26 -49.44 77.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.027 0.441 . . . . 0.0 110.146 -178.925 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.1 tp -61.31 -30.36 70.45 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.36 -179.609 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.98 -49.91 72.85 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 122.224 -0.298 . . . . 0.0 110.579 177.862 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.94 -41.55 83.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.963 0.411 . . . . 0.0 110.464 178.422 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 92.6 mt -54.16 -53.03 32.1 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.748 179.23 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.6 mttp -53.8 -27.64 30.47 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -178.134 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -60.46 -32.2 71.18 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -176.503 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.3 mm -107.4 -41.08 5.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.864 0.364 . . . . 0.0 110.44 -176.031 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -115.13 83.36 9.83 Favored Pre-proline 0 CA--C 1.534 0.332 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.206 -178.691 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -53.65 -20.8 17.58 Favored 'Trans proline' 0 N--CA 1.498 1.759 0 C-N-CA 121.505 1.47 . . . . 0.0 113.422 -176.254 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -99.23 22.03 11.08 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.756 0.651 . . . . 0.0 112.756 -175.225 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -110.57 127.36 55.18 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 173.262 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.7 pttp -122.99 -24.54 4.74 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -175.788 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.3 tp10 -127.77 140.26 52.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.726 0.298 . . . . 0.0 110.594 -179.768 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 52.6 mt -98.1 132.17 43.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.341 -0.39 . . . . 0.0 109.998 174.239 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.1 t -92.87 -47.13 13.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.173 179.938 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -155.02 156.31 35.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.038 178.69 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.4 p -143.03 131.98 22.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.098 0.475 . . . . 0.0 111.125 179.683 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.3 t -107.22 125.91 51.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.663 177.39 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 87.3 p -54.33 -37.77 65.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.309 -172.255 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -151.84 126.62 9.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.146 0.498 . . . . 0.0 111.688 -178.997 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 99.2 t -145.26 140.17 22.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.474 -177.713 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.15 149.88 50.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.147 -178.067 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -97.89 133.62 42.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.187 0.518 . . . . 0.0 111.749 -176.383 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -126.56 142.0 51.68 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.467 178.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 82.0 m -120.47 146.77 45.92 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.818 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -108.48 131.94 54.31 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.988 0.423 . . . . 0.0 110.471 176.125 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 -104.37 115.98 31.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.962 177.51 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 87.9 p -69.06 -31.46 70.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.064 -176.816 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.2 t -60.9 -39.84 90.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.763 0.316 . . . . 0.0 110.876 -177.58 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -94.43 -21.38 18.96 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -178.703 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 69.79 43.62 0.93 Allowed 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.355 0.598 . . . . 0.0 109.748 -177.922 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -151.26 162.9 40.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.103 -177.77 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 88.0 m95 -94.76 142.53 27.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.373 177.639 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -124.34 126.69 46.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 0.0 109.905 175.527 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 38.8 tttp -73.95 139.81 45.13 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.394 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 67.2 p -92.4 171.89 8.75 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.153 -178.365 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -83.75 12.49 5.88 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 178.681 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.5 t -102.43 106.47 19.94 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-O 120.964 0.411 . . . . 0.0 110.291 179.719 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -131.1 114.89 15.7 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 176.717 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.61 176.52 38.93 Favored Glycine 0 CA--C 1.519 0.295 0 C-N-CA 120.054 -1.069 . . . . 0.0 112.411 -169.67 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -81.26 134.7 35.64 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 175.145 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -98.3 127.57 44.3 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.079 -176.473 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -131.84 142.27 49.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.276 177.654 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 68.5 mt -101.59 127.71 54.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 172.308 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 16.3 m-30 -108.47 136.86 47.38 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.838 0.352 . . . . 0.0 111.216 -175.922 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 68.2 t60 -114.68 141.64 47.55 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.34 175.295 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -142.31 146.93 35.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.835 176.459 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -86.77 28.09 0.92 Allowed 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.998 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.37 172.8 17.69 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.765 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -64.04 124.68 86.07 Favored Pre-proline 0 CA--C 1.539 0.535 0 CA-C-O 118.55 -0.738 . . . . 0.0 110.081 -178.129 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -79.11 140.98 60.46 Favored 'Cis proline' 0 N--CA 1.495 1.609 0 CA-C-N 121.79 1.675 . . . . 0.0 111.537 -1.677 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -63.73 -46.37 85.67 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.922 -177.613 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -142.37 136.22 29.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.274 0.559 . . . . 0.0 110.664 -177.46 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.3 t -150.26 151.33 32.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.454 -177.396 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 50.1 mt -110.86 139.51 34.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -179.228 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -131.83 142.06 49.61 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.81 -176.796 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 60.9 mt -123.82 127.31 73.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.214 0.531 . . . . 0.0 109.813 172.463 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 -94.25 99.54 11.76 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.011 -0.995 . . . . 0.0 109.445 -179.756 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.8 t-20 -74.48 105.75 5.76 Favored 'General case' 0 C--N 1.332 -0.165 0 O-C-N 123.728 0.642 . . . . 0.0 110.951 -175.474 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -71.84 -42.11 67.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.602 -170.879 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.8 mt -73.32 -45.17 56.88 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.781 -173.794 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 52.3 m-20 -95.07 -3.42 48.19 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -175.573 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.1 m 53.04 42.76 32.25 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.493 0.663 . . . . 0.0 111.039 177.095 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.1 m -128.49 132.68 48.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.585 -178.146 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 86.8 p -76.66 130.71 38.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.412 -179.296 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -118.0 122.26 42.74 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 172.965 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 31.4 t -125.55 146.39 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-O 120.745 0.307 . . . . 0.0 110.764 -176.399 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -147.88 126.37 6.09 Favored Pre-proline 0 CA--C 1.539 0.526 0 CA-C-O 118.633 -0.699 . . . . 0.0 110.43 173.836 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -75.47 150.91 36.83 Favored 'Trans proline' 0 N--CA 1.499 1.83 0 C-N-CA 121.453 1.435 . . . . 0.0 112.282 177.682 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 68.3 mt -93.21 134.64 30.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.229 177.715 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.1 p -132.14 158.06 42.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.702 177.401 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -94.27 34.96 4.4 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.059 -178.567 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.0 t -111.09 -21.15 12.1 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 173.79 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.9 mt -68.61 149.04 49.63 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-O 120.925 0.393 . . . . 0.0 111.379 -176.149 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -115.34 135.87 53.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.682 176.265 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 70.5 mt -114.81 155.21 27.19 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.913 0.387 . . . . 0.0 110.823 -176.963 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -148.7 142.77 25.93 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 178.317 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.6 t -103.52 109.19 20.75 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.645 -0.422 . . . . 0.0 110.919 -179.849 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -106.8 103.81 48.71 Favored Pre-proline 0 C--N 1.329 -0.318 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 171.333 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.09 141.91 49.36 Favored 'Trans proline' 0 N--CA 1.496 1.666 0 CA-C-N 120.477 1.206 . . . . 0.0 111.964 -172.126 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -89.86 11.66 58.31 Favored 'Cis proline' 0 N--CA 1.5 1.853 0 CA-C-N 121.108 1.431 . . . . 0.0 113.629 -3.613 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -90.41 168.25 12.01 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-O 120.62 0.248 . . . . 0.0 110.901 -178.365 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 54.6 tp -118.39 135.02 54.58 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 171.52 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.5 tp -126.97 139.15 53.26 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.539 0.209 . . . . 0.0 110.563 -174.487 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -143.13 148.63 36.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.986 0.422 . . . . 0.0 110.178 175.543 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 25.9 mtm180 -103.44 150.56 23.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.135 -175.854 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 24.1 m120 -129.98 162.69 28.09 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.812 0.815 . . . . 0.0 111.221 -179.769 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 51.6 tt0 -49.51 149.55 2.27 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.72 -177.014 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 64.76 30.88 12.17 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.351 -0.841 . . . . 0.0 112.116 -179.834 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 18.2 m 66.64 35.11 5.45 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.958 0.409 . . . . 0.0 111.605 165.652 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 46.9 mtp85 -98.99 143.29 29.45 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.988 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 75.9 mt -117.68 126.1 74.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-O 121.181 0.515 . . . . 0.0 110.055 -175.412 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 81.4 mmt-85 -130.95 147.35 52.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.444 178.788 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -139.66 166.42 25.6 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 -178.143 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -125.33 139.8 53.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.878 0.371 . . . . 0.0 110.516 -179.741 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 15.5 t90 -107.49 124.81 50.44 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.464 174.314 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -113.84 143.34 44.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.785 0.326 . . . . 0.0 110.667 -179.481 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -51.24 -35.96 39.47 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.618 178.232 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.5 t-20 -136.04 134.4 38.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.371 179.39 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.0 t -60.79 -41.42 95.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.012 -177.654 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -59.82 -43.21 94.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.315 0.578 . . . . 0.0 110.194 178.881 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -56.78 -45.32 82.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.511 0.672 . . . . 0.0 109.966 179.05 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 42.2 t -59.94 -39.04 84.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.711 178.351 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -59.31 -45.98 89.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.914 0.388 . . . . 0.0 110.577 -177.303 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 60.4 ttm-85 -59.36 -48.45 81.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.998 0.428 . . . . 0.0 110.523 -177.923 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 30.8 mm -58.23 -45.97 88.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.058 -178.709 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 60.3 p -59.28 -43.07 92.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.665 -177.37 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.79 -44.37 94.25 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.654 -0.978 . . . . 0.0 110.654 -178.879 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 10.8 mt -58.4 -49.39 77.43 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.162 0.506 . . . . 0.0 110.528 -178.428 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 52.6 t -59.12 -42.63 87.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.13 -178.597 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -57.68 -41.96 82.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.795 0.331 . . . . 0.0 110.594 -178.95 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -60.84 -45.79 95.8 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.954 -0.859 . . . . 0.0 110.954 -179.806 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 58.6 mt -58.68 -42.28 88.17 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.901 0.381 . . . . 0.0 110.548 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 59.1 mt . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.796 -179.38 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 13.1 mt . . . . . 0 C--O 1.233 0.235 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -79.01 139.75 15.44 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 121.172 1.248 . . . . 0.0 111.343 174.986 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -97.08 125.97 44.01 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-O 118.451 -0.785 . . . . 0.0 109.886 179.901 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -78.13 161.88 29.11 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 121.258 1.305 . . . . 0.0 111.868 176.177 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -50.86 150.01 13.54 Favored 'Trans proline' 0 N--CA 1.494 1.524 0 C-N-CA 121.293 1.329 . . . . 0.0 111.642 177.811 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 81.0 mt -49.91 -28.36 6.56 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -176.611 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 68.3 t80 -55.37 -38.39 68.76 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.859 0.361 . . . . 0.0 111.173 -176.923 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 9.2 t90 -60.6 -48.06 83.46 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.301 -176.57 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -64.0 -48.5 76.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.898 0.38 . . . . 0.0 110.863 -176.983 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.36 -45.47 91.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.87 -176.326 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -59.75 -47.33 86.1 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.612 -176.424 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.12 -46.93 87.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.032 0.444 . . . . 0.0 110.753 -177.436 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.286 -176.284 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.326 0 N-CA-C 109.557 -1.417 . . . . 15.7 109.557 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -49.17 143.84 18.06 Favored 'Trans proline' 0 N--CA 1.495 1.593 0 C-N-CA 121.374 1.383 . . . . 14.93 112.041 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -137.4 138.95 40.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.11 -0.496 . . . . 18.62 110.589 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 64.8 mtt -102.89 142.87 33.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 13.92 110.553 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -68.04 150.48 48.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 10.65 110.589 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -71.73 127.48 32.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 7.58 110.559 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 6.4 mp -69.61 -37.92 77.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.193 -0.458 . . . . 8.47 111.097 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.3 mtt -78.33 138.9 38.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.814 0.34 . . . . 5.86 110.774 -178.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -103.3 152.64 21.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.129 -0.487 . . . . 3.49 110.524 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.94 141.32 55.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.141 -0.481 . . . . 2.25 110.717 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -62.67 -33.44 75.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 2.69 111.593 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 90.7 p -56.32 -40.05 73.76 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.898 0.38 . . . . 1.74 110.725 -178.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.4 mm -60.07 -46.3 94.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.279 -0.419 . . . . 1.21 110.182 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 36.2 m -58.85 -44.91 91.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.3 -0.409 . . . . 1.08 110.369 -177.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -59.22 -45.24 91.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.096 -0.502 . . . . 3.92 110.594 -178.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 96.9 mmm -58.2 -43.37 87.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.034 0.445 . . . . 2.07 110.417 -178.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.9 m120 -60.03 -49.46 77.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.156 -0.475 . . . . 1.76 110.202 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.4 tp -61.49 -30.07 70.38 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.593 -0.443 . . . . 1.08 111.368 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.05 -50.45 70.6 Favored 'General case' 0 C--N 1.333 -0.142 0 O-C-N 122.281 -0.262 . . . . 1.04 110.551 177.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.94 -42.01 84.01 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.078 0.466 . . . . 1.05 110.373 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 97.6 mt -54.05 -53.08 30.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.692 -0.685 . . . . 1.06 110.66 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 54.2 mttm -53.1 -26.46 16.51 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.551 0.574 . . . . 2.0 112.551 -178.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -59.49 -33.18 71.01 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 111.904 0.335 . . . . 3.89 111.904 -177.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 48.8 mm -104.48 -44.3 8.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.047 0.451 . . . . 1.12 110.089 -177.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -114.7 85.43 11.42 Favored Pre-proline 0 CA--C 1.534 0.338 0 CA-C-N 115.707 -0.679 . . . . 0.32 110.236 -176.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.07 -21.68 13.1 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 C-N-CA 121.399 1.399 . . . . 0.66 113.42 -176.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.0 p90 -100.01 17.2 21.62 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.347 0.869 . . . . 2.14 113.347 -174.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -94.31 118.97 32.38 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 109.09 -0.707 . . . . 1.08 109.09 173.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -108.8 -37.78 5.79 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 120.835 -0.346 . . . . 3.42 111.513 -172.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -128.33 147.96 50.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.873 0.368 . . . . 1.78 110.979 -176.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 58.7 mt -102.98 131.77 50.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.009 -0.542 . . . . 1.06 109.926 173.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.8 t -92.1 -47.22 14.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.916 0.389 . . . . 1.06 110.031 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -155.9 156.17 34.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.028 -0.533 . . . . 0.13 110.059 178.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 59.7 p -142.5 132.0 23.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.936 0.398 . . . . 0.84 110.58 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.2 t -106.52 129.72 54.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.925 -0.579 . . . . 0.83 109.797 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 30.2 m -54.2 -38.7 65.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.715 -0.675 . . . . 1.74 111.251 -172.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -152.72 127.8 9.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.178 0.513 . . . . 0.38 111.598 -178.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 99.3 t -145.19 143.85 21.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.004 -0.998 . . . . 1.03 109.539 -177.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -131.15 149.82 52.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.562 -0.29 . . . . 1.03 111.094 -178.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -99.2 131.48 45.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.277 0.56 . . . . 2.36 111.507 -177.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -127.44 143.91 51.13 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 115.946 -0.57 . . . . 0.96 110.823 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 86.4 m -121.89 148.56 44.58 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.24 -0.652 . . . . 1.08 109.24 177.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -109.45 131.95 54.59 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.999 0.428 . . . . 1.91 110.441 176.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 -103.78 114.17 28.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.878 -0.601 . . . . 0.48 109.718 176.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 86.6 p -68.92 -30.3 68.73 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.903 -0.59 . . . . 1.59 112.196 -176.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.8 p -62.4 -39.17 92.37 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.686 0.279 . . . . 1.8 110.932 -177.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -94.5 -21.51 18.84 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.607 0.595 . . . . 2.48 112.607 -179.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 69.82 44.49 0.84 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 121.414 0.626 . . . . 2.06 109.652 -177.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -149.87 160.87 43.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.614 -0.721 . . . . 1.93 111.09 -177.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 80.7 m95 -94.66 140.76 29.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.085 -0.507 . . . . 0.3 110.379 177.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -122.87 129.08 51.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.274 -0.421 . . . . 2.3 110.039 177.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 72.9 tttt -76.84 140.39 40.63 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.948 -0.39 . . . . 3.02 109.948 178.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.1 p -92.34 176.0 6.64 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.723 -0.391 . . . . 1.1 110.131 -179.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -86.17 12.94 8.66 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.638 0.607 . . . . 2.17 112.638 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.8 t -106.94 106.42 20.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-O 120.916 0.389 . . . . 1.11 110.381 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -130.39 113.02 13.82 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.575 -0.898 . . . . 0.29 108.575 174.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.66 176.48 38.97 Favored Glycine 0 CA--C 1.52 0.376 0 C-N-CA 120.191 -1.004 . . . . 0.11 112.361 -168.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -79.37 136.15 36.91 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.9 -0.778 . . . . 0.92 108.9 174.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -101.94 127.23 48.87 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.96 -0.296 . . . . 0.11 110.388 -175.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -130.61 142.19 50.45 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.785 0.326 . . . . 0.11 110.647 177.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 68.1 mt -101.55 127.1 55.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.241 -0.652 . . . . 1.03 109.241 171.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 13.8 m-30 -108.58 138.17 45.32 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.015 0.436 . . . . 0.81 111.285 -177.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 68.2 t60 -111.5 143.38 42.45 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.359 -0.837 . . . . 0.37 110.213 175.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -139.51 147.11 40.81 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.873 -0.603 . . . . 3.18 110.002 178.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -86.92 28.13 0.93 Allowed 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.15 -0.477 . . . . 2.04 112.136 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.52 160.79 38.57 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.735 -0.468 . . . . 1.04 109.735 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -63.98 131.16 94.87 Favored Pre-proline 0 CA--C 1.54 0.581 0 CA-C-O 118.483 -0.77 . . . . 2.53 110.059 -176.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -71.79 140.86 67.96 Favored 'Cis proline' 0 N--CA 1.498 1.752 0 CA-C-N 121.734 1.655 . . . . 0.84 111.58 -1.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -63.95 -40.43 96.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.278 -0.419 . . . . 2.25 111.079 -177.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -142.65 141.35 31.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.589 0.709 . . . . 0.34 111.044 -176.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.3 t -149.19 151.55 34.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.595 -0.729 . . . . 0.74 110.02 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 57.0 mt -115.62 138.98 44.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.43 . . . . 1.03 109.883 -177.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -131.85 142.14 49.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.787 -0.642 . . . . 2.19 111.1 -177.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.4 mt -120.33 128.99 76.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-O 121.235 0.54 . . . . 1.04 109.578 171.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -94.73 99.5 11.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.022 -0.99 . . . . 0.11 109.191 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.3 t-20 -72.53 105.84 4.36 Favored 'General case' 0 C--N 1.333 -0.138 0 O-C-N 123.65 0.594 . . . . 0.2 111.031 -174.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -73.87 -40.96 62.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.836 -0.62 . . . . 3.96 111.252 -171.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 70.9 mt -70.81 -45.23 64.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.359 -0.382 . . . . 1.09 111.644 -175.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 62.3 m-20 -95.06 -3.33 48.41 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 113.761 1.023 . . . . 2.0 113.761 -175.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.5 m 55.88 43.41 27.57 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-O 121.521 0.677 . . . . 1.79 110.49 177.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 34.5 m -127.45 148.87 50.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.441 -0.799 . . . . 1.1 110.618 -178.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.1 p -100.82 131.95 46.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.09 -0.505 . . . . 0.79 110.88 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -128.57 122.18 30.44 Favored 'General case' 0 N--CA 1.462 0.175 0 N-CA-C 110.204 -0.295 . . . . 2.29 110.204 175.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 p -125.57 149.95 30.59 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 116.358 -0.383 . . . . 1.92 111.004 -177.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -149.35 136.86 11.26 Favored Pre-proline 0 CA--C 1.538 0.488 0 CA-C-O 119.053 -0.499 . . . . 1.81 110.755 174.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.39 150.91 37.19 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 121.691 1.594 . . . . 0.39 112.378 178.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 64.4 mt -89.39 123.76 41.77 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 C-N-CA 120.657 -0.417 . . . . 1.08 110.47 178.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 40.4 p -99.35 159.02 15.31 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.073 -0.512 . . . . 1.25 110.065 175.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -98.41 7.75 61.94 Favored Glycine 0 CA--C 1.534 1.231 0 C-N-CA 120.97 -0.633 . . . . 0.5 113.597 -178.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.8 p -98.76 -5.31 31.56 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 117.947 0.873 . . . . 1.65 112.932 177.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.5 mt -68.99 141.18 54.98 Favored 'General case' 0 C--O 1.232 0.143 0 O-C-N 122.062 -0.398 . . . . 1.56 111.47 -177.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 57.2 tt0 -112.08 135.83 52.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.086 -0.507 . . . . 0.66 109.638 175.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.4 mt -113.84 158.38 21.1 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.03 0.443 . . . . 1.11 111.25 -175.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -148.71 145.68 27.78 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.814 -0.81 . . . . 0.77 108.814 176.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.1 t -114.63 109.3 18.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.009 0.433 . . . . 0.87 111.433 -177.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -106.82 103.54 47.61 Favored Pre-proline 0 CA--C 1.532 0.262 0 N-CA-C 108.672 -0.862 . . . . 1.29 108.672 169.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -62.08 141.86 90.29 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 CA-C-N 120.593 1.248 . . . . 0.72 111.457 -171.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -95.38 14.48 41.32 Favored 'Cis proline' 0 N--CA 1.497 1.724 0 CA-C-N 121.143 1.444 . . . . 0.5 113.649 -3.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -107.45 136.64 46.9 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 122.525 -0.11 . . . . 2.18 110.896 -175.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 36.5 tp -92.93 136.58 33.12 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 120.503 -0.479 . . . . 1.05 110.63 -176.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.7 tp -124.02 139.64 53.75 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.068 -0.515 . . . . 1.13 110.324 -173.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.1 p90 -143.96 153.95 42.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.822 0.344 . . . . 2.12 110.586 176.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 27.0 mtm105 -101.98 146.82 27.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.103 -0.499 . . . . 2.08 110.606 -178.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 16.5 t30 -129.97 168.43 16.69 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.667 0.746 . . . . 2.23 111.552 -177.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -47.08 145.8 2.01 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.566 -0.743 . . . . 2.32 112.233 -176.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 60.3 mtp180 63.82 30.91 14.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.168 -0.924 . . . . 4.07 112.146 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.2 m 65.19 35.12 8.01 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.949 0.404 . . . . 1.69 111.524 167.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 36.2 mtp180 -98.28 151.98 19.91 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.307 -0.627 . . . . 3.12 109.307 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 72.3 mt -117.12 127.52 74.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 121.153 0.502 . . . . 1.06 110.068 -176.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 81.0 mtt85 -138.41 150.33 46.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.66 -0.7 . . . . 2.18 109.495 178.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.7 168.77 26.26 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 120.787 -0.72 . . . . 0.24 111.81 -176.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -125.27 135.02 52.1 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.279 -0.46 . . . . 2.37 110.269 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 46.5 t90 -107.46 131.01 54.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.012 -0.54 . . . . 0.99 109.899 177.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -117.17 149.77 39.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.792 0.329 . . . . 2.06 110.602 -179.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -52.63 -37.71 58.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.137 -0.483 . . . . 2.1 111.441 176.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.5 t-20 -131.28 135.2 47.1 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.467 -0.333 . . . . 0.41 110.53 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.7 t -61.97 -41.99 98.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.271 -0.422 . . . . 1.78 111.084 -177.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -60.03 -43.68 95.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.432 0.634 . . . . 0.97 110.096 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -56.43 -44.59 80.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.635 -0.711 . . . . 0.16 109.996 178.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 38.0 t -59.83 -38.5 82.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.494 -0.775 . . . . 0.9 110.732 177.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -59.11 -46.32 88.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.917 0.389 . . . . 1.63 110.527 -177.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 -59.54 -49.17 78.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.141 0.496 . . . . 3.9 110.599 -177.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 27.5 mm -58.49 -46.51 89.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.42 0.629 . . . . 1.03 109.973 -178.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 20.9 m -58.65 -40.9 84.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.97 -0.559 . . . . 1.17 110.682 -177.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -56.9 -42.43 92.34 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 110.688 -0.965 . . . . 0.18 110.688 -179.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 16.0 mt -57.79 -50.05 74.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.438 0.637 . . . . 1.03 110.275 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 53.1 t -58.46 -43.62 87.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.546 -0.752 . . . . 1.06 110.109 -177.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 24.4 m120 -57.45 -41.51 80.65 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.3 -0.409 . . . . 1.78 110.634 -178.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.43 -45.63 95.5 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 111.184 -0.766 . . . . 0.29 111.184 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 66.8 mt -57.89 -41.7 83.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.899 0.38 . . . . 1.06 110.621 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 88.5 mt -59.64 -40.57 88.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.007 -0.542 . . . . 1.26 110.749 -179.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 16.7 pttp -93.95 -3.32 51.77 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 113.392 0.886 . . . . 1.95 113.392 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 24.4 t -131.09 135.22 47.33 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 118.127 0.421 . . . . 1.96 110.622 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 56.3 tttp . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 117.989 -1.005 . . . . 3.95 110.628 -179.969 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.346 0 N-CA-C 109.53 -1.428 . . . . 25.57 109.53 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -49.57 140.91 27.6 Favored 'Trans proline' 0 N--CA 1.496 1.629 0 C-N-CA 121.31 1.34 . . . . 25.15 112.005 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 57.7 tp60 -100.16 125.56 46.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.244 -0.434 . . . . 21.37 110.506 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -67.86 153.41 95.24 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.278 -0.419 . . . . 19.71 110.532 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -78.82 140.31 16.22 Favored 'Trans proline' 0 N--CA 1.493 1.493 0 C-N-CA 121.396 1.397 . . . . 18.62 112.038 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 6.4 mp -63.08 -41.49 99.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.176 -0.465 . . . . 18.11 110.607 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.5 mt -108.96 136.71 48.05 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.245 -0.434 . . . . 15.89 110.391 179.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -124.48 134.19 53.12 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.325 -0.398 . . . . 13.9 110.547 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -89.8 -58.49 2.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.18 -0.464 . . . . 17.69 110.361 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -129.23 156.51 43.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.118 -0.492 . . . . 13.8 110.263 179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -72.92 111.87 8.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 10.02 110.511 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.65 155.95 39.67 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.464 . . . . 8.1 110.567 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -74.65 140.72 26.85 Favored 'Trans proline' 0 N--CA 1.494 1.521 0 C-N-CA 121.301 1.334 . . . . 7.22 111.945 178.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 12.1 t80 -133.83 99.88 13.68 Favored Pre-proline 0 CA--C 1.534 0.335 0 CA-C-O 119.076 -0.487 . . . . 6.59 110.392 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -59.34 128.91 29.09 Favored 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 121.066 1.177 . . . . 4.33 111.586 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 100.25 -5.17 57.37 Favored Glycine 0 CA--C 1.534 1.267 0 CA-C-N 116.026 -0.534 . . . . 3.35 113.466 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -88.49 120.72 30.13 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 118.204 1.002 . . . . 3.4 110.459 178.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 7.2 ttt -78.39 140.42 60.43 Favored Pre-proline 0 CA--C 1.533 0.32 0 CA-C-O 118.947 -0.549 . . . . 1.29 110.004 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -71.66 151.51 58.19 Favored 'Trans proline' 0 N--CA 1.496 1.656 0 C-N-CA 121.232 1.288 . . . . 1.31 111.639 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 25.8 m120 -101.16 110.43 22.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.841 0.353 . . . . 3.34 110.746 -178.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 8.4 mt -69.91 151.23 96.29 Favored Pre-proline 0 C--N 1.33 -0.262 0 N-CA-C 109.59 -0.522 . . . . 1.11 109.59 177.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -79.06 139.79 15.37 Favored 'Trans proline' 0 N--CA 1.492 1.386 0 C-N-CA 121.057 1.171 . . . . 0.72 111.08 174.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -97.17 125.78 44.54 Favored Pre-proline 0 CA--C 1.535 0.391 0 CA-C-O 118.512 -0.756 . . . . 2.88 109.955 179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -78.18 169.04 20.9 Favored 'Trans proline' 0 N--CA 1.497 1.721 0 C-N-CA 121.311 1.34 . . . . 1.07 112.015 176.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -65.18 157.08 59.46 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 121.328 1.352 . . . . 0.99 111.396 176.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 9.8 tt -50.0 -32.82 16.14 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.131 0.419 . . . . 2.45 112.131 -176.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 58.4 t80 -54.28 -36.16 63.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.85 0.357 . . . . 4.15 111.418 -176.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 12.1 t90 -61.75 -48.18 81.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.37 -0.377 . . . . 0.49 110.448 -176.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -62.45 -47.93 81.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.042 0.449 . . . . 2.44 110.574 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -59.45 -44.49 92.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.142 -0.481 . . . . 2.96 110.905 -177.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -59.03 -46.39 88.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.249 -0.432 . . . . 1.53 110.654 -176.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.53 -48.0 83.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.113 0.482 . . . . 1.09 110.631 -177.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.11 -42.23 90.04 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.974 -0.557 . . . . 2.64 111.141 -176.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -64.42 -47.97 77.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 3.86 111.05 -177.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -55.01 -45.91 75.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.303 -0.408 . . . . 2.66 111.17 -178.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 43.0 tp10 -65.0 -36.99 86.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.374 -0.375 . . . . 1.84 111.054 178.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -76.26 147.97 37.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.801 0.334 . . . . 2.01 110.526 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 13.1 tp . . . . . 0 C--O 1.221 -0.421 0 CA-C-O 118.007 -0.997 . . . . 4.2 110.497 179.943 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.72 -31.38 49.16 Favored 'Trans proline' 0 N--CA 1.496 1.619 0 C-N-CA 121.319 1.346 . . . . 0.0 112.212 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 75.5 m80 -131.3 162.8 29.23 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.487 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 86.0 mtp -115.17 162.97 16.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.457 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -57.84 141.5 48.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.556 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -84.14 120.56 26.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.442 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 29.4 tp -56.53 -39.97 74.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.896 -179.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.0 mmm -93.79 127.73 39.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.481 -179.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.72 149.52 21.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.565 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -97.36 105.96 18.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.559 179.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -66.76 -35.74 80.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.321 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.6 p -56.87 -40.69 76.63 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.89 0.376 . . . . 0.0 110.721 -177.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mm -60.39 -47.18 93.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.0 0.429 . . . . 0.0 110.211 -178.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.6 m -58.94 -43.88 91.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.565 -177.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.0 mtp85 -59.75 -44.95 93.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.626 -178.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 97.2 mmm -58.24 -43.92 88.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.005 0.431 . . . . 0.0 110.425 -178.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -60.7 -49.69 76.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.271 -178.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.6 tp -59.33 -32.9 70.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.05 -179.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.69 -50.68 68.26 Favored 'General case' 0 C--N 1.332 -0.166 0 O-C-N 122.294 -0.254 . . . . 0.0 110.906 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.75 -41.71 82.45 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.99 0.424 . . . . 0.0 110.502 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 94.9 mt -54.18 -53.07 31.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.715 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -52.88 -21.34 4.16 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -57.91 -35.4 71.01 Favored 'General case' 0 C--N 1.332 -0.169 0 O-C-N 122.33 -0.231 . . . . 0.0 111.477 -177.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 45.8 mm -113.01 -39.78 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-O 120.776 0.322 . . . . 0.0 110.554 -177.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -117.29 77.2 9.65 Favored Pre-proline 0 CA--C 1.535 0.367 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.162 -178.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -55.69 -21.49 32.13 Favored 'Trans proline' 0 N--CA 1.498 1.738 0 C-N-CA 121.512 1.475 . . . . 0.0 113.396 -175.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -88.69 8.76 27.04 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -174.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -86.81 124.77 33.42 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 174.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -105.61 -39.35 6.12 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.798 0.332 . . . . 0.0 111.173 -174.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -134.72 144.78 47.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.97 0.414 . . . . 0.0 111.064 -176.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 24.4 mt -96.34 131.32 43.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 172.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.1 t -91.49 -47.19 14.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 0.0 109.929 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -153.03 152.01 30.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.844 178.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.9 p -139.86 131.94 27.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.083 0.468 . . . . 0.0 110.958 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 45.0 t -105.37 126.9 52.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.654 176.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.1 m -54.4 -38.9 66.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.191 -172.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -151.31 127.04 10.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.217 0.532 . . . . 0.0 111.501 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 96.5 t -144.91 142.31 22.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.526 -177.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -131.53 149.87 52.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.203 -178.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -100.68 131.33 46.64 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.656 -176.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -127.16 144.45 51.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.819 178.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 74.7 m -122.46 149.48 43.81 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -109.48 131.93 54.61 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.854 0.359 . . . . 0.0 110.316 175.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.0 t-20 -103.92 114.7 29.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.73 176.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 84.8 p -68.6 -31.41 70.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.058 -177.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.2 m -61.91 -38.61 89.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.686 0.279 . . . . 0.0 110.964 -177.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -95.1 -21.44 18.54 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -178.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 51.0 t30 68.95 45.65 0.92 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-O 121.411 0.624 . . . . 0.0 109.343 -177.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 76.8 tt0 -151.49 150.58 30.54 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.281 -176.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 78.2 m95 -85.32 138.46 32.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.871 175.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -122.05 126.39 48.37 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 177.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -73.8 139.71 45.35 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 177.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.7 p -92.31 175.42 6.85 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.181 -178.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.6 p30 -86.51 13.71 7.98 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.1 t -108.5 106.42 20.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 121.047 0.451 . . . . 0.0 110.342 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -131.49 112.1 12.36 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 174.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.64 176.56 38.95 Favored Glycine 0 CA--C 1.522 0.48 0 C-N-CA 120.125 -1.036 . . . . 0.0 112.283 -168.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -77.47 135.85 38.3 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 174.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -103.04 126.96 50.45 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.368 -175.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -130.04 142.07 50.66 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.744 0.307 . . . . 0.0 110.72 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 68.3 mt -101.59 126.9 55.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 171.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 14.2 m-30 -108.65 138.56 44.77 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.995 0.426 . . . . 0.0 111.552 -177.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -108.82 143.34 38.13 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.976 173.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -140.49 146.34 38.05 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.111 178.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -86.88 28.11 0.93 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 112.1 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.97 162.77 38.22 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -63.91 129.88 94.13 Favored Pre-proline 0 CA--C 1.539 0.528 0 CA-C-O 118.448 -0.787 . . . . 0.0 110.002 -177.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -73.46 140.93 70.01 Favored 'Cis proline' 0 N--CA 1.498 1.793 0 CA-C-N 121.867 1.703 . . . . 0.0 111.681 -1.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -63.09 -40.73 98.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.925 -177.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -143.02 140.51 31.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.401 0.619 . . . . 0.0 110.944 -177.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.5 t -149.81 152.31 34.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.281 -178.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 53.1 mt -116.13 138.65 45.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 -177.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -131.87 142.09 49.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.135 -176.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.6 mt -121.05 131.47 72.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.186 0.517 . . . . 0.0 109.833 172.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -98.71 99.56 10.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.902 -1.044 . . . . 0.0 109.335 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.4 t-20 -73.2 107.71 5.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.271 0.558 . . . . 0.0 111.268 -174.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -73.47 -39.38 64.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.272 -172.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 70.2 mt -73.23 -45.19 57.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.719 -174.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -95.05 -3.42 48.27 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.753 1.019 . . . . 0.0 113.753 -175.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.8 m 55.95 43.14 27.82 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 121.477 0.656 . . . . 0.0 110.49 177.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.8 m -130.13 149.02 52.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.332 -178.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.0 p -102.66 139.98 37.54 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.094 -179.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -134.64 122.25 22.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.185 177.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.7 p -125.55 148.49 30.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.038 -177.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 55.5 tt0 -148.66 137.07 11.62 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-O 119.063 -0.494 . . . . 0.0 110.622 175.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.53 150.95 36.63 Favored 'Trans proline' 0 N--CA 1.498 1.744 0 C-N-CA 121.67 1.58 . . . . 0.0 112.268 178.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 63.4 mt -89.42 121.07 39.15 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 C-N-CA 120.711 -0.395 . . . . 0.0 110.363 178.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 71.0 p -99.1 160.8 14.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.052 176.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -97.38 7.31 63.83 Favored Glycine 0 CA--C 1.533 1.215 0 C-N-CA 120.877 -0.678 . . . . 0.0 113.607 -178.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.7 p -99.04 -3.75 34.04 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 117.927 0.863 . . . . 0.0 113.015 177.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.0 mt -68.36 144.45 54.77 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 118.1 0.409 . . . . 0.0 111.166 -177.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.1 tt0 -115.97 135.84 53.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.78 176.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 60.0 mt -117.23 157.74 25.51 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.896 0.379 . . . . 0.0 110.854 -176.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -150.14 143.36 25.0 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.0 t -98.59 109.11 21.92 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.491 178.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -106.87 103.75 48.64 Favored Pre-proline 0 C--N 1.328 -0.329 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 172.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -70.4 143.11 46.82 Favored 'Trans proline' 0 N--CA 1.497 1.702 0 CA-C-N 120.541 1.229 . . . . 0.0 112.027 -171.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -90.94 14.59 50.13 Favored 'Cis proline' 0 N--CA 1.5 1.858 0 CA-C-N 121.041 1.407 . . . . 0.0 113.481 -3.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -95.97 172.28 8.1 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.531 0.205 . . . . 0.0 110.627 -177.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.8 tp -113.98 135.01 54.46 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 172.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.0 tp -126.02 139.19 53.62 Favored 'General case' 0 C--N 1.333 -0.114 0 N-CA-C 110.428 -0.212 . . . . 0.0 110.428 -173.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 50.8 p90 -145.97 154.43 41.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.965 0.412 . . . . 0.0 110.627 174.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.6 mtm180 -104.75 149.13 25.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.729 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -129.96 165.56 21.87 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.856 0.836 . . . . 0.0 111.549 -178.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -48.45 146.54 2.86 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.524 -0.762 . . . . 0.0 112.1 -176.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 38.8 ttp180 65.23 30.95 11.08 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.289 -0.869 . . . . 0.0 112.041 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 46.9 t 66.05 35.23 6.43 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.858 0.361 . . . . 0.0 111.538 166.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 18.7 mmm180 -97.89 148.24 23.63 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 76.9 mt -113.66 128.55 70.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -178.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -138.75 150.31 45.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.535 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.33 169.32 25.89 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 111.494 -0.642 . . . . 0.0 111.494 -175.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -125.19 139.87 53.36 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 120.951 0.405 . . . . 0.0 110.909 -177.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 65.5 t90 -106.22 125.39 50.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.533 174.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 67.7 m-85 -117.19 140.31 49.69 Favored 'General case' 0 C--N 1.33 -0.258 0 O-C-N 123.262 0.351 . . . . 0.0 110.539 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -50.49 -39.71 49.17 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.908 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -131.72 137.26 48.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.664 0.268 . . . . 0.0 110.372 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 84.3 p -62.28 -42.28 99.21 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.144 -177.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -59.01 -44.19 91.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.431 0.634 . . . . 0.0 109.961 178.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -55.94 -44.22 78.18 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.152 178.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 49.2 t -60.07 -40.65 90.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.594 178.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -59.09 -46.1 89.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.904 0.383 . . . . 0.0 110.634 -176.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.0 mtm180 -61.04 -49.38 77.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.817 -177.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 26.8 mm -58.65 -44.3 89.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.996 0.427 . . . . 0.0 109.963 -178.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.8 m -59.36 -44.19 92.74 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.667 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.59 -44.36 93.92 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 -178.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.2 mt -59.03 -49.09 79.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.145 0.498 . . . . 0.0 110.607 -178.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 56.9 t -58.97 -42.66 86.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.164 -178.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -57.74 -42.75 84.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.881 0.372 . . . . 0.0 110.552 -178.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.65 -42.28 99.73 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 -179.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.4 mt -62.69 -43.12 99.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.774 0.321 . . . . 0.0 111.105 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 65.4 mt -63.81 -44.91 91.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.458 -176.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 26.6 pttt -71.5 -35.41 70.75 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.508 -177.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 29.0 t -86.48 141.48 29.06 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.758 0.313 . . . . 0.0 110.533 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 65.1 tttm . . . . . 0 C--O 1.221 -0.435 0 CA-C-O 118.045 -0.979 . . . . 0.0 110.572 -179.832 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.35 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -50.76 140.33 37.91 Favored 'Trans proline' 0 N--CA 1.495 1.562 0 C-N-CA 121.294 1.329 . . . . 0.0 112.012 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -115.51 148.58 39.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.493 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -68.29 154.28 94.36 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.537 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.16 -31.16 36.86 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 121.25 1.3 . . . . 0.0 112.259 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 28.8 tp -56.51 -39.8 73.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.864 -179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 26.8 tp -97.56 133.5 42.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.729 -179.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 96.8 mm-40 -102.34 145.01 30.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.451 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -59.39 -41.34 89.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.662 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -104.02 138.45 40.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.435 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 60.6 ttm-85 -74.87 123.64 25.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.559 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.62 164.69 14.17 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.535 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -49.5 150.71 8.06 Favored 'Trans proline' 0 N--CA 1.496 1.63 0 C-N-CA 121.339 1.359 . . . . 0.0 111.943 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -60.9 150.79 76.25 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.382 -179.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -57.82 128.92 30.93 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 121.134 1.222 . . . . 0.0 111.878 -178.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 96.7 -5.08 64.08 Favored Glycine 0 CA--C 1.534 1.23 0 CA-C-O 119.651 -0.527 . . . . 0.0 113.594 177.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -106.94 117.91 35.31 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 118.278 1.039 . . . . 0.0 110.587 178.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 6.3 ttp -93.08 143.3 26.55 Favored Pre-proline 0 CA--C 1.533 0.307 0 CA-C-O 118.992 -0.528 . . . . 0.0 109.953 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -58.46 143.41 97.89 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 121.169 1.246 . . . . 0.0 111.757 177.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 8.1 p30 -99.46 117.55 34.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.679 -179.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 17.7 mt -83.3 151.95 63.64 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.312 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.17 139.87 15.25 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 C-N-CA 121.163 1.242 . . . . 0.0 110.981 173.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 49.0 mmtt -97.11 125.76 44.74 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-O 118.892 -0.575 . . . . 0.0 109.982 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -75.8 154.13 38.58 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 121.392 1.394 . . . . 0.0 111.381 171.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -51.68 152.11 13.5 Favored 'Trans proline' 0 N--CA 1.496 1.633 0 C-N-CA 121.271 1.314 . . . . 0.0 111.621 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.3 tp -50.0 -29.74 9.23 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -177.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -55.15 -37.27 66.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.815 0.34 . . . . 0.0 111.223 -177.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 35.5 t90 -60.89 -48.03 83.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.181 -177.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -61.7 -49.44 76.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.088 0.471 . . . . 0.0 110.482 -177.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -59.96 -45.44 92.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.974 -176.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -59.44 -47.33 85.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.713 -175.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.73 -48.56 81.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.823 -176.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -59.54 -44.62 93.17 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.144 -175.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 76.2 mttt -65.37 -47.43 76.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.297 -177.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -55.1 -47.42 74.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.164 -178.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 43.0 tp10 -64.95 -37.01 86.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.078 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -67.74 144.57 55.36 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.792 0.33 . . . . 0.0 110.535 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 29.7 tp . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.53 179.969 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.283 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -68.79 145.39 62.65 Favored 'Trans proline' 0 N--CA 1.495 1.604 0 C-N-CA 121.276 1.317 . . . . 0.0 111.937 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -57.18 -42.86 81.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.721 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 43.3 ttm -105.69 147.52 28.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.529 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -137.36 150.78 47.95 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.47 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -95.59 150.77 19.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.622 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 6.3 mp -59.59 -40.13 86.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.821 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.8 mtp -72.05 151.06 43.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.611 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -57.67 145.69 33.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.53 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -138.66 170.05 16.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.637 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -60.67 -36.44 78.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.096 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.2 t -56.71 -41.25 77.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.954 0.407 . . . . 0.0 110.594 -178.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.2 mm -59.87 -46.07 94.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.133 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.2 m -58.84 -44.71 90.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.449 -177.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -59.7 -45.13 93.05 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.66 -178.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 89.6 mtp -58.25 -42.92 87.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.996 0.427 . . . . 0.0 110.416 -178.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -60.13 -49.97 75.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.216 -178.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.2 tp -61.31 -30.5 70.54 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.631 -0.427 . . . . 0.0 111.342 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.57 -49.78 73.89 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 122.219 -0.301 . . . . 0.0 110.505 178.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.16 -42.32 85.74 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.032 0.444 . . . . 0.0 110.336 178.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 95.6 mt -54.24 -52.98 33.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.755 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -55.62 -26.55 44.71 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -177.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 52.8 mttm -59.98 -30.82 69.37 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -177.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.9 mm -107.63 -42.49 6.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.843 0.354 . . . . 0.0 110.319 -176.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -114.7 84.6 10.35 Favored Pre-proline 0 CA--C 1.533 0.315 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.473 -176.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -53.11 -22.95 20.72 Favored 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 121.528 1.486 . . . . 0.0 113.338 -177.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.2 p90 -97.51 22.07 9.39 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 -175.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -107.89 122.4 46.72 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 171.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 46.1 mtmt -116.71 -30.14 5.88 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -174.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -128.84 142.25 51.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.763 0.316 . . . . 0.0 110.862 -178.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 57.6 mt -98.98 132.42 44.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.85 174.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 43.6 t -94.41 -47.14 13.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.195 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -154.05 153.76 32.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.181 178.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.5 p -141.72 131.99 24.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.943 0.401 . . . . 0.0 110.749 178.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 38.3 t -106.98 129.15 54.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.726 176.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.8 m -54.27 -38.22 65.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.252 -172.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -152.73 126.66 9.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.141 0.496 . . . . 0.0 111.759 -178.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 99.3 t -145.19 142.64 22.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.534 -177.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.93 149.89 50.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.68 -0.236 . . . . 0.0 111.022 -179.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -98.72 132.58 43.99 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.33 0.586 . . . . 0.0 111.602 -177.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -129.54 143.94 51.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.666 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 96.5 m -121.98 149.56 43.29 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -110.91 131.99 54.58 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.997 0.427 . . . . 0.0 110.535 177.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 -104.41 114.91 29.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.811 176.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.1 m -67.84 -32.69 73.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.987 -177.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.0 t -60.27 -39.48 86.96 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.719 0.295 . . . . 0.0 110.9 -177.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -94.45 -21.42 18.92 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 26.5 t30 69.41 43.78 1.0 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.348 0.594 . . . . 0.0 109.739 -177.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.5 mt-10 -150.43 161.83 41.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.124 -177.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 81.8 m95 -94.89 140.0 30.54 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.416 177.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -119.75 126.42 51.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.477 . . . . 0.0 109.951 176.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.9 ttpm? -74.4 140.12 44.51 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 178.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 74.3 p -92.25 176.46 6.48 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.412 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -88.36 13.39 11.81 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 45.2 t -108.1 106.42 20.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 121.03 0.443 . . . . 0.0 110.475 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -129.35 112.75 14.16 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 174.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.56 38.96 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 120.114 -1.041 . . . . 0.0 112.237 -168.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.38 136.42 37.67 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 175.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -100.91 126.28 47.53 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.178 -175.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -129.58 142.25 50.79 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.744 0.307 . . . . 0.0 110.55 177.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 68.9 mt -101.61 126.87 55.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 171.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 14.3 m-30 -108.58 137.48 46.46 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.827 0.346 . . . . 0.0 111.229 -177.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 50.9 t60 -112.07 143.25 43.39 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.004 174.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 33.8 tpt85 -142.21 147.89 37.29 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.268 177.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -86.94 28.21 0.93 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.218 -0.447 . . . . 0.0 112.077 -179.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.02 169.79 23.77 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -64.01 125.25 87.58 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.982 -178.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -78.34 140.97 63.2 Favored 'Cis proline' 0 N--CA 1.496 1.642 0 CA-C-N 121.911 1.718 . . . . 0.0 111.843 -1.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -61.54 -42.22 98.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.903 -177.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -143.63 139.8 29.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.353 0.596 . . . . 0.0 110.891 -177.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.3 t -149.9 151.26 33.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.303 -177.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 48.1 mt -113.47 137.67 45.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 -178.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -131.82 142.2 49.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.355 -176.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.4 mt -120.66 130.35 74.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 121.202 0.525 . . . . 0.0 109.662 172.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -96.96 99.56 11.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.937 -1.029 . . . . 0.0 109.205 179.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -71.89 107.58 4.72 Favored 'General case' 0 C--N 1.332 -0.181 0 O-C-N 123.666 0.604 . . . . 0.0 111.089 -174.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 78.3 ttt-85 -73.33 -42.41 62.33 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.397 -171.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 48.7 mt -72.27 -45.09 61.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.633 -175.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -95.08 -3.22 48.55 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 -175.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 69.7 p 50.93 42.64 28.44 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.511 0.672 . . . . 0.0 111.183 177.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 32.4 m -127.67 135.53 50.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.334 -179.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.3 p -85.36 136.81 33.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.354 -178.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -132.71 122.17 24.2 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.347 175.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 13.2 p -125.59 150.31 30.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.209 -178.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -148.28 136.37 11.2 Favored Pre-proline 0 CA--C 1.537 0.466 0 CA-C-O 119.106 -0.473 . . . . 0.0 110.567 174.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -75.43 151.01 37.13 Favored 'Trans proline' 0 N--CA 1.498 1.774 0 C-N-CA 121.704 1.602 . . . . 0.0 112.403 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 64.5 mt -90.78 125.44 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.151 177.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 40.6 p -98.49 160.29 14.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.264 176.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -82.35 -22.09 59.36 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 121.218 -0.515 . . . . 0.0 113.124 -176.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.9 p -87.02 10.15 17.39 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -177.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.7 mt -66.88 131.82 46.7 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 118.109 0.413 . . . . 0.0 111.098 -177.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -112.35 135.8 52.6 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.901 176.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 70.5 mt -119.23 157.83 27.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.023 0.439 . . . . 0.0 111.087 -175.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -144.08 135.71 25.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.473 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.0 t -97.72 109.33 22.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.994 0.426 . . . . 0.0 111.241 -177.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 12.6 mt-30 -106.57 129.22 24.79 Favored Pre-proline 0 CA--C 1.534 0.362 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 173.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -79.26 128.95 8.42 Favored 'Trans proline' 0 N--CA 1.494 1.551 0 CA-C-N 120.651 1.268 . . . . 0.0 111.878 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -98.71 19.25 26.22 Favored 'Cis proline' 0 N--CA 1.5 1.889 0 CA-C-N 122.121 1.793 . . . . 0.0 113.026 -6.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -112.58 132.94 54.88 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.713 0.292 . . . . 0.0 111.371 -171.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 35.5 tp -90.22 135.04 33.91 Favored 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.702 -172.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 7.5 tp -123.53 143.01 50.46 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.519 -175.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 33.8 p90 -143.38 152.27 41.4 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.835 0.35 . . . . 0.0 110.199 175.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 27.0 mtm180 -104.64 144.58 31.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.714 -176.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -129.1 167.76 17.09 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.915 0.864 . . . . 0.0 111.619 -177.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 52.1 tt0 -48.52 149.33 1.68 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.983 -176.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 62.05 30.96 18.03 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.212 -0.904 . . . . 0.0 112.172 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 7.5 m 65.11 35.29 8.04 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.842 0.354 . . . . 0.0 111.541 166.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 90.0 mtt-85 -97.48 147.02 24.66 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 73.0 mt -115.57 124.19 71.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 -177.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 81.1 mtm180 -137.24 150.32 47.76 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -146.6 169.44 27.8 Favored Glycine 0 CA--C 1.523 0.555 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.956 -175.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -125.15 136.53 53.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.165 -0.517 . . . . 0.0 110.534 -178.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 70.4 t90 -106.57 125.82 51.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.597 176.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -113.47 146.36 39.71 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.837 0.351 . . . . 0.0 110.646 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -52.32 -36.13 52.51 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.569 177.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 33.1 t-20 -133.21 133.75 43.15 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.786 0.327 . . . . 0.0 110.491 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 22.9 m -61.21 -40.64 94.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.169 -178.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -61.0 -43.18 99.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.322 0.582 . . . . 0.0 110.189 179.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -57.0 -45.19 83.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.569 0.699 . . . . 0.0 110.032 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 46.8 t -59.58 -38.56 81.52 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.766 177.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -58.63 -45.52 89.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.888 0.375 . . . . 0.0 110.484 -177.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 64.1 mtp85 -59.74 -48.22 82.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.539 -178.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 30.5 mm -58.2 -44.97 88.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.093 0.473 . . . . 0.0 110.044 -178.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 54.3 p -59.51 -44.6 93.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.715 -177.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.51 -43.25 94.17 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.655 -0.978 . . . . 0.0 110.655 -178.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.6 mt -59.07 -49.13 79.06 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.154 0.502 . . . . 0.0 110.552 -178.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 53.2 t -58.54 -43.05 86.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.207 -177.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -58.24 -43.86 88.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.643 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.51 -38.99 96.71 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.461 -0.656 . . . . 0.0 111.461 -179.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 36.8 mt -65.3 -43.98 89.37 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.624 0.249 . . . . 0.0 111.341 179.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 40.8 mt -60.5 -44.55 95.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.078 -176.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -73.33 -37.57 66.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.276 -177.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.7 m -65.73 162.42 18.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.649 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 77.7 tttt . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.5 179.953 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.379 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -66.38 143.08 68.54 Favored 'Trans proline' 0 N--CA 1.496 1.642 0 CA-C-N 119.319 1.56 . . . . 0.0 111.913 -175.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -101.45 145.96 28.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.573 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -77.11 154.19 82.54 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.591 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -76.93 -28.3 6.25 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 121.357 1.371 . . . . 0.0 112.619 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 79.6 mt -56.13 -39.79 72.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.904 -179.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 25.9 tp -99.39 127.79 45.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.51 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -124.61 131.52 53.47 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.47 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -64.82 -40.48 95.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.81 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -100.63 158.21 16.1 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.649 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 89.6 mtt180 -110.57 148.28 32.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.498 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -89.32 158.11 46.67 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.398 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 15.4 Cg_endo -57.43 153.63 40.04 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 121.34 1.36 . . . . 0.0 111.541 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 25.9 m-85 -139.63 158.01 69.01 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.933 -178.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -57.89 129.0 31.15 Favored 'Trans proline' 0 N--CA 1.495 1.602 0 C-N-CA 121.174 1.249 . . . . 0.0 111.686 -179.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 104.96 -5.16 42.26 Favored Glycine 0 CA--C 1.535 1.325 0 CA-C-O 119.507 -0.607 . . . . 0.0 113.373 179.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -85.88 139.2 31.46 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 118.323 1.061 . . . . 0.0 110.344 175.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 10.4 ttt -61.2 118.13 33.32 Favored Pre-proline 0 CA--C 1.535 0.402 0 CA-C-O 118.669 -0.682 . . . . 0.0 110.255 -178.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -57.43 144.33 92.0 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 121.075 1.183 . . . . 0.0 111.648 175.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 40.1 t30 -97.21 103.31 15.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.602 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 17.0 mt -63.75 152.17 87.14 Favored Pre-proline 0 C--N 1.33 -0.279 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.07 139.79 15.36 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 C-N-CA 121.091 1.194 . . . . 0.0 111.158 174.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -97.14 125.88 44.2 Favored Pre-proline 0 CA--C 1.535 0.394 0 CA-C-O 118.442 -0.79 . . . . 0.0 109.706 179.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -78.1 167.12 23.88 Favored 'Trans proline' 0 N--CA 1.496 1.63 0 CA-C-N 120.607 1.253 . . . . 0.0 111.813 177.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -61.54 156.35 47.64 Favored 'Trans proline' 0 N--CA 1.494 1.551 0 C-N-CA 121.292 1.328 . . . . 0.0 111.218 177.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 23.8 tp -49.95 -30.15 9.82 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -176.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -56.53 -36.72 69.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.762 0.315 . . . . 0.0 111.388 -176.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 5.9 t90 -61.54 -48.19 82.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.851 0.358 . . . . 0.0 110.309 -176.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -64.88 -48.66 73.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.041 0.448 . . . . 0.0 110.863 -178.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 61.8 tt0 -58.56 -43.36 89.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.883 -176.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -59.74 -48.16 82.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.597 -176.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -58.21 -47.59 83.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.135 0.493 . . . . 0.0 110.617 -177.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -60.75 -43.14 98.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.295 -176.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 71.3 tttt -62.47 -45.66 92.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.134 -177.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -59.67 -49.0 79.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.946 -178.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -80.92 14.91 2.0 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -104.55 137.57 42.2 Favored 'General case' 0 C--N 1.333 -0.126 0 O-C-N 122.185 -0.322 . . . . 0.0 110.453 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 28.2 tp . . . . . 0 C--O 1.22 -0.478 0 CA-C-O 118.012 -0.995 . . . . 0.0 110.481 179.755 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.229 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -66.44 142.78 66.96 Favored 'Trans proline' 0 N--CA 1.496 1.656 0 CA-C-N 118.911 1.356 . . . . 0.0 111.838 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -58.55 -41.3 85.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.673 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 85.9 mtp -134.78 160.17 39.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.622 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -143.03 153.96 43.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.425 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -79.32 99.94 7.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.556 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 3.8 tt -85.12 -48.3 9.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.462 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.3 mtt -115.97 172.21 7.3 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.449 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -130.35 161.84 30.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.42 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -57.43 142.53 43.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.59 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -62.49 -37.78 87.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.232 -177.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 16.6 t -58.71 -47.28 85.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.078 0.466 . . . . 0.0 110.339 -177.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 45.5 mm -59.54 -41.25 84.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.242 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.8 m -60.05 -45.18 93.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.881 0.372 . . . . 0.0 110.631 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 59.9 ttt85 -59.66 -46.98 87.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.993 0.425 . . . . 0.0 110.459 -178.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 86.1 mtp -58.18 -43.13 87.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.232 0.539 . . . . 0.0 110.375 -178.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -60.53 -48.3 82.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.33 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.4 tp -60.5 -33.63 72.9 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.058 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.47 -50.04 73.02 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.655 0.264 . . . . 0.0 110.608 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.16 -41.36 88.19 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.005 0.431 . . . . 0.0 110.553 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 95.6 mt -54.18 -52.97 32.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.53 178.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -53.28 -25.33 14.27 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -177.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 55.6 mttm -59.72 -32.65 70.73 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -177.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.2 mm -108.86 -42.78 5.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.958 0.409 . . . . 0.0 110.253 -177.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -117.18 77.32 9.37 Favored Pre-proline 0 CA--C 1.535 0.397 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.912 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -55.35 -20.6 26.22 Favored 'Trans proline' 0 N--CA 1.498 1.774 0 C-N-CA 121.481 1.454 . . . . 0.0 113.431 -175.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.4 p90 -90.6 10.23 26.42 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -174.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.74 126.45 32.4 Favored 'General case' 0 C--O 1.231 0.097 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 175.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -97.9 -40.47 8.48 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.799 -0.361 . . . . 0.0 110.778 -176.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -153.05 156.73 39.3 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.549 -0.461 . . . . 0.0 111.565 -179.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 61.8 mt -93.16 138.1 20.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.068 177.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.2 t -90.05 -45.97 15.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.684 176.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -156.74 157.62 35.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.85 178.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.6 p -142.49 132.32 24.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.138 0.494 . . . . 0.0 111.205 -179.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 24.7 t -106.16 124.46 49.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.5 176.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.3 m -54.12 -38.22 65.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.302 -171.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 52.7 t-80 -150.39 126.46 10.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.19 0.519 . . . . 0.0 111.651 -178.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 93.4 t -145.14 138.18 21.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.403 -177.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -126.26 149.84 48.82 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.029 -178.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -98.76 129.99 45.21 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 121.319 0.58 . . . . 0.0 111.682 -176.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -125.43 142.86 51.27 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.461 178.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 90.1 m -121.66 146.61 46.83 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -108.37 131.96 54.22 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.929 0.395 . . . . 0.0 110.395 176.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 31.3 t-20 -104.3 116.13 31.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.91 177.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 86.1 p -68.63 -31.89 71.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.966 -177.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.7 m -61.31 -39.36 90.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.777 0.322 . . . . 0.0 110.909 -177.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -93.7 -21.4 19.37 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 28.1 t30 68.96 42.95 1.22 Allowed 'General case' 0 C--O 1.232 0.134 0 CA-C-O 121.299 0.571 . . . . 0.0 109.8 -177.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -151.54 163.99 37.82 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.106 -177.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 83.0 m95 -94.92 140.92 29.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.322 177.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -122.89 131.34 53.7 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 176.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -76.15 139.79 41.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.278 178.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.3 p -92.32 171.99 8.7 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.699 -0.401 . . . . 0.0 109.944 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -85.81 13.82 6.79 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 178.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.6 t -105.15 106.47 20.57 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 CA-C-O 120.959 0.409 . . . . 0.0 110.464 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -130.34 114.94 16.23 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 175.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.58 176.47 38.91 Favored Glycine 0 CA--C 1.52 0.384 0 C-N-CA 120.065 -1.064 . . . . 0.0 112.372 -169.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -81.64 135.97 35.53 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 175.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -99.55 128.83 45.67 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.127 -176.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -132.08 143.53 50.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.339 177.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 68.9 mt -101.51 128.41 53.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 171.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 14.8 m-30 -108.54 135.56 49.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.007 0.432 . . . . 0.0 111.189 -175.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -115.42 142.48 46.65 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.098 176.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -142.07 146.98 36.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.089 178.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -86.87 28.01 0.94 Allowed 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 178.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.36 165.42 34.77 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -63.89 130.34 94.4 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-O 118.563 -0.732 . . . . 0.0 110.206 -177.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -72.84 140.87 69.42 Favored 'Cis proline' 0 N--CA 1.497 1.694 0 CA-C-N 121.717 1.649 . . . . 0.0 111.331 -3.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -66.45 -43.47 85.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.025 -177.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 69.3 m80 -141.78 136.63 30.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.296 0.569 . . . . 0.0 110.768 -176.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.1 t -151.03 152.25 33.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.476 -178.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 43.9 mt -109.3 140.07 29.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -131.75 141.99 49.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.733 -177.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.4 mt -126.48 130.12 71.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.265 0.555 . . . . 0.0 110.076 173.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -97.81 99.86 11.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 114.946 -1.025 . . . . 0.0 109.776 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -73.27 107.12 5.41 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.802 0.689 . . . . 0.0 110.958 -176.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -71.81 -49.2 40.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.456 -171.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 44.0 mt -67.49 -45.01 77.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.519 -175.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -95.08 -3.0 48.95 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -174.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 11.5 t 44.63 41.39 4.83 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.348 0.594 . . . . 0.0 112.015 178.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 40.1 m -121.25 137.5 54.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.074 -0.967 . . . . 0.0 109.87 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 77.5 p -81.06 132.99 35.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.586 -176.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -119.66 122.16 40.88 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 174.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 38.2 t -125.53 145.81 32.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 120.68 0.276 . . . . 0.0 110.672 -177.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -148.15 126.36 5.96 Favored Pre-proline 0 CA--C 1.538 0.514 0 CA-C-O 118.621 -0.704 . . . . 0.0 110.464 173.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -75.45 150.86 36.87 Favored 'Trans proline' 0 N--CA 1.499 1.838 0 C-N-CA 121.571 1.514 . . . . 0.0 112.316 177.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 67.3 mt -94.25 135.6 28.1 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-O 120.934 0.397 . . . . 0.0 110.077 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.5 p -132.1 157.7 43.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.795 177.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -89.57 32.93 4.55 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.286 -178.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t -111.07 -20.56 12.35 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 173.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.6 mt -68.69 146.49 52.93 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.878 0.37 . . . . 0.0 111.133 -176.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -121.78 135.91 54.93 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.847 176.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 65.5 mt -113.87 159.0 20.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.698 -177.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -148.01 141.51 25.4 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 177.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.9 t -107.12 109.32 21.13 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.92 0.39 . . . . 0.0 111.209 -178.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -106.79 103.63 47.88 Favored Pre-proline 0 CA--C 1.532 0.277 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 170.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -64.03 145.32 89.53 Favored 'Trans proline' 0 N--CA 1.497 1.722 0 CA-C-N 120.523 1.223 . . . . 0.0 111.85 -170.188 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -93.95 18.43 37.95 Favored 'Cis proline' 0 N--CA 1.498 1.779 0 CA-C-N 120.904 1.358 . . . . 0.0 113.183 -3.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -110.59 159.96 17.09 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 110.342 -0.244 . . . . 0.0 110.342 -176.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 31.3 tp -110.76 133.63 53.17 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 122.075 -0.39 . . . . 0.0 111.275 -177.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.2 tp -122.08 140.28 52.71 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.141 -174.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 36.2 p90 -143.16 157.83 44.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.776 0.322 . . . . 0.0 110.467 176.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 31.0 mtm105 -101.85 147.33 26.64 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.893 0.378 . . . . 0.0 110.917 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -128.51 160.8 31.19 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.968 0.889 . . . . 0.0 111.619 -177.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -48.75 148.97 1.91 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.06 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 43.5 mtp180 64.25 30.9 13.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.252 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 47.8 t 67.62 35.24 4.16 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.94 0.4 . . . . 0.0 111.586 165.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -101.89 151.26 22.31 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 74.2 mt -114.1 126.19 71.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -179.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -138.06 150.37 46.84 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -148.51 169.46 29.09 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.043 -175.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -125.15 138.84 54.15 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.992 0.425 . . . . 0.0 110.663 -178.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 44.7 t90 -107.05 125.71 51.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.693 176.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -111.68 144.4 41.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.827 0.346 . . . . 0.0 110.669 -179.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -52.39 -38.03 57.94 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.553 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 -131.48 134.35 46.07 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.761 0.315 . . . . 0.0 110.494 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.8 m -61.87 -42.46 99.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.064 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -59.84 -43.39 94.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.371 0.605 . . . . 0.0 110.061 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -56.68 -44.22 81.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.509 0.671 . . . . 0.0 110.12 178.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 42.6 t -59.92 -40.27 88.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.675 178.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -59.57 -44.53 93.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.777 0.323 . . . . 0.0 110.674 -177.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -59.74 -49.5 77.5 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.011 0.434 . . . . 0.0 110.461 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 30.3 mm -58.3 -45.02 89.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.14 0.495 . . . . 0.0 110.038 -178.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 56.5 p -59.43 -43.51 93.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.733 -177.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.62 -43.9 94.13 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 110.653 -0.979 . . . . 0.0 110.653 -178.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.2 mt -59.12 -49.89 76.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.063 0.458 . . . . 0.0 110.601 -178.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 56.9 t -58.93 -42.81 87.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.129 -178.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -57.77 -43.25 85.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.535 -178.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -60.9 -44.97 97.46 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 111.016 -0.833 . . . . 0.0 111.016 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 61.7 mt -57.77 -42.87 84.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.966 0.413 . . . . 0.0 110.488 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 70.4 mt -59.85 -41.89 92.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.686 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 18.1 pttm -97.62 11.21 37.76 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 27.2 t -126.11 139.63 53.22 Favored 'General case' 0 C--O 1.231 0.082 0 O-C-N 122.064 -0.398 . . . . 0.0 110.42 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 67.9 mttm . . . . . 0 C--O 1.221 -0.421 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.606 179.998 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.405 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -64.91 140.91 68.71 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 CA-C-N 119.322 1.561 . . . . 0.0 111.923 -175.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -120.91 148.55 43.9 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.518 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 44.6 m-20 -82.47 156.78 68.33 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.544 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -86.04 27.62 0.58 Allowed 'Trans proline' 0 N--CA 1.492 1.407 0 C-N-CA 121.572 1.514 . . . . 0.0 112.825 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 29.2 tp -62.61 -39.74 94.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.739 0.304 . . . . 0.0 110.779 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.2 mt -78.33 147.29 34.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.509 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -72.43 155.82 39.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.554 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 57.5 tp60 -56.26 -39.93 73.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.802 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 97.4 mm-40 -65.69 146.23 55.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.452 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 32.9 ttp180 -77.98 120.41 22.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.591 -179.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.57 162.45 19.91 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.329 179.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -52.95 160.53 4.06 Favored 'Trans proline' 0 N--CA 1.495 1.559 0 C-N-CA 121.354 1.37 . . . . 0.0 111.601 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -93.18 99.9 3.65 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 119.132 -0.461 . . . . 0.0 110.494 -179.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -58.64 128.98 30.2 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 121.114 1.21 . . . . 0.0 111.6 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 99.59 -5.16 58.4 Favored Glycine 0 CA--C 1.536 1.345 0 CA-C-O 119.566 -0.575 . . . . 0.0 113.4 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -64.55 137.31 57.78 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 118.23 1.015 . . . . 0.0 110.432 178.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 7.8 ttp -92.98 118.13 67.76 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 118.531 -0.747 . . . . 0.0 110.385 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -53.61 141.99 61.89 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 CA-C-N 120.543 1.229 . . . . 0.0 111.744 177.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 40.2 t30 -87.53 107.68 18.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.52 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 17.6 mt -68.58 151.3 97.32 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.288 -0.415 . . . . 0.0 109.97 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -79.17 139.86 15.24 Favored 'Trans proline' 0 N--CA 1.492 1.393 0 C-N-CA 121.2 1.267 . . . . 0.0 111.201 174.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -97.03 125.7 45.12 Favored Pre-proline 0 CA--C 1.535 0.377 0 CA-C-O 118.8 -0.619 . . . . 0.0 110.022 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -74.15 155.61 47.1 Favored 'Trans proline' 0 N--CA 1.496 1.636 0 C-N-CA 121.488 1.459 . . . . 0.0 111.774 173.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -53.63 154.68 15.37 Favored 'Trans proline' 0 N--CA 1.496 1.625 0 C-N-CA 121.341 1.361 . . . . 0.0 111.561 177.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 6.2 mp -50.42 -29.63 10.63 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -176.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -55.52 -38.58 69.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.865 0.364 . . . . 0.0 111.138 -177.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 8.9 t90 -60.97 -48.08 83.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.136 -177.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -61.29 -49.88 75.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.14 0.495 . . . . 0.0 110.592 -177.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -60.17 -46.21 90.45 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.006 -175.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -58.69 -46.15 87.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.717 -176.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.99 -49.32 77.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.881 -177.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -59.15 -43.77 92.07 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.312 -175.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 61.0 mttp -67.15 -49.55 64.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.534 -177.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 61.3 tt0 -55.08 -49.04 72.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.352 -176.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 65.1 tt0 -68.42 -36.99 79.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.238 -179.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -56.62 141.64 42.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.841 0.353 . . . . 0.0 110.723 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 78.1 mt . . . . . 0 C--O 1.221 -0.426 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.526 -179.982 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.333 0 N-CA-C 109.616 -1.393 . . . . 0.0 109.616 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.98 -33.27 32.95 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 CA-C-N 118.853 1.326 . . . . 0.0 112.072 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -57.11 -41.36 78.82 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.686 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 85.8 mtp -97.44 125.01 41.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.561 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -103.57 132.04 50.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.601 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -93.54 126.88 38.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.5 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 78.5 mt -57.11 -41.6 79.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.618 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.9 mtm -142.55 135.45 28.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.48 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.22 144.75 32.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.608 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -83.58 111.67 19.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.448 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -65.14 -32.99 74.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.608 -179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.6 m -56.33 -40.79 74.99 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.855 0.36 . . . . 0.0 110.737 -177.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.3 mm -60.64 -47.3 93.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.203 -178.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 32.1 m -58.92 -43.67 91.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.531 -177.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -59.62 -45.35 92.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.488 -178.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 66.5 mtt -58.21 -44.35 88.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.117 0.484 . . . . 0.0 110.434 -178.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.9 m120 -60.37 -48.91 79.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.383 -178.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.4 tp -60.76 -32.89 72.18 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.21 -178.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.62 -49.92 73.3 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.638 0.256 . . . . 0.0 110.686 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.87 -41.95 88.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.021 0.439 . . . . 0.0 110.514 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 93.4 mt -54.27 -52.97 33.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.632 178.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -53.84 -20.72 6.23 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -58.29 -34.88 71.02 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 122.266 -0.271 . . . . 0.0 111.589 -178.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.6 mm -112.97 -39.51 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 CA-C-O 120.757 0.313 . . . . 0.0 110.617 -177.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -117.18 77.2 9.29 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.178 -178.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -55.99 -21.09 32.59 Favored 'Trans proline' 0 N--CA 1.497 1.735 0 C-N-CA 121.491 1.461 . . . . 0.0 113.432 -175.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 37.2 p90 -89.11 7.05 37.1 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -174.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -80.61 122.67 27.37 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 174.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.0 ttmm -97.71 -40.4 8.59 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.846 -174.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -149.29 152.53 36.05 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.344 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 41.5 mt -93.27 137.18 23.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.875 177.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.1 t -90.21 -45.99 14.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.704 177.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -156.49 157.08 34.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.908 178.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.8 p -142.39 132.79 25.0 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.996 0.426 . . . . 0.0 111.12 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 14.9 t -107.83 126.35 52.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.663 175.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 88.1 p -54.81 -37.94 66.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.343 -171.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -150.31 125.91 10.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.116 0.484 . . . . 0.0 111.724 -178.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 95.6 t -145.24 143.67 21.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.774 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -131.21 149.48 52.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.866 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -99.22 131.29 45.35 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.261 0.553 . . . . 0.0 111.475 -177.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -124.68 139.71 53.6 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.507 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 72.7 m -119.92 146.8 45.45 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 177.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -106.8 132.03 53.23 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 120.983 0.42 . . . . 0.0 110.381 175.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 30.3 t-20 -104.42 115.79 30.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.947 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.0 m -67.54 -33.01 74.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.899 -177.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.3 p -61.63 -38.57 88.17 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 121.023 -0.271 . . . . 0.0 110.916 -177.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -93.75 -21.42 19.33 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 69.03 42.5 1.26 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.268 0.556 . . . . 0.0 109.825 -177.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -152.27 165.1 35.95 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.144 -177.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -93.88 141.42 28.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.357 177.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -125.03 126.48 45.47 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 176.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -72.86 141.05 47.95 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 177.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 63.3 p -92.19 177.38 6.17 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.254 -178.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -87.09 14.19 8.0 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 45.2 t -109.28 106.37 20.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 120.966 0.412 . . . . 0.0 110.366 179.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -129.91 111.9 13.01 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 173.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.71 176.49 39.01 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 120.192 -1.004 . . . . 0.0 112.176 -168.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.09 135.43 37.71 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 174.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -100.42 128.26 46.53 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 -176.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -131.56 143.04 50.08 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.249 177.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 69.6 mt -101.54 127.78 54.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 172.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 -108.48 137.35 46.58 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.984 0.421 . . . . 0.0 111.298 -175.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 30.5 t60 -117.78 143.25 46.41 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.173 175.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 62.6 ttt180 -142.03 148.37 38.36 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.093 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -86.95 28.15 0.94 Allowed 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.95 164.76 36.52 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -64.01 129.47 93.94 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-O 118.491 -0.766 . . . . 0.0 110.012 -177.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.93 140.87 69.71 Favored 'Cis proline' 0 N--CA 1.497 1.71 0 CA-C-N 121.804 1.68 . . . . 0.0 111.693 -1.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -65.61 -44.72 85.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.007 -177.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -142.79 137.37 29.66 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.442 0.639 . . . . 0.0 110.924 -176.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.4 t -150.61 152.3 33.85 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.326 -177.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 46.1 mt -110.86 138.54 38.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -179.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -131.87 141.93 49.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.066 -176.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.1 mt -123.06 133.25 69.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.218 0.532 . . . . 0.0 109.872 172.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -100.77 99.56 10.11 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.553 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.2 t-20 -71.53 108.58 4.99 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 123.716 0.635 . . . . 0.0 111.023 -175.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -74.82 -38.37 62.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.405 -171.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 67.0 mt -72.9 -45.17 59.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.46 -175.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 49.5 m-20 -95.12 -3.08 48.67 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -175.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.9 p 51.34 42.39 29.07 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.507 0.67 . . . . 0.0 111.03 178.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 40.9 m -127.44 149.07 50.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.812 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 52.7 p -101.86 144.77 30.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.896 0.379 . . . . 0.0 111.292 -177.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -138.6 122.25 17.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.189 177.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.7 p -125.55 148.93 30.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.074 -178.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 48.3 tt0 -147.9 136.61 11.5 Favored Pre-proline 0 CA--C 1.537 0.48 0 CA-C-O 119.059 -0.496 . . . . 0.0 110.597 175.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -75.31 150.89 37.5 Favored 'Trans proline' 0 N--CA 1.497 1.733 0 C-N-CA 121.673 1.582 . . . . 0.0 112.435 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 65.2 mt -90.59 123.69 42.87 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-O 120.935 0.398 . . . . 0.0 110.382 178.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.0 p -99.15 160.88 13.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.003 176.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -98.23 6.03 61.37 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 120.972 -0.632 . . . . 0.0 113.683 -177.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 62.7 m -100.34 -0.96 37.33 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.035 0.917 . . . . 0.0 113.034 177.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.1 mt -69.23 139.92 54.5 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-N 118.105 0.412 . . . . 0.0 111.411 -177.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.7 tt0 -111.43 135.82 51.45 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.539 174.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 74.4 mt -112.99 156.91 22.22 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.149 0.499 . . . . 0.0 111.371 -175.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -142.09 140.0 32.4 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.7 t -104.83 109.1 20.92 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.982 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -106.94 103.69 48.59 Favored Pre-proline 0 C--N 1.329 -0.297 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 170.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.1 141.49 48.06 Favored 'Trans proline' 0 N--CA 1.497 1.685 0 CA-C-N 120.627 1.26 . . . . 0.0 111.833 -172.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -90.54 11.74 57.89 Favored 'Cis proline' 0 N--CA 1.498 1.773 0 CA-C-N 121.154 1.448 . . . . 0.0 113.699 -3.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -91.3 170.7 9.77 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.544 0.211 . . . . 0.0 110.806 -177.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 47.4 tp -120.8 135.96 55.02 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 173.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.3 tp -127.14 140.02 52.55 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -175.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -143.77 155.91 44.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.878 0.371 . . . . 0.0 110.602 175.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 27.5 mtm105 -101.9 146.62 27.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.723 -178.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -128.07 163.75 23.91 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.722 0.772 . . . . 0.0 111.385 -177.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -47.31 146.17 2.06 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.227 -177.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 25.1 mmt85 65.12 30.9 11.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.173 -0.922 . . . . 0.0 112.136 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.6 m 66.36 35.17 5.9 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.898 0.38 . . . . 0.0 111.616 166.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -99.35 150.06 22.52 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 77.8 mt -114.47 127.76 71.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 121.076 0.465 . . . . 0.0 109.774 -178.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 90.3 mtt180 -137.24 145.91 44.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.412 178.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.85 169.35 25.29 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -125.29 138.77 54.09 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.783 0.325 . . . . 0.0 110.909 -178.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 77.8 t90 -104.09 126.74 51.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.517 175.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -115.6 141.37 48.16 Favored 'General case' 0 C--N 1.33 -0.276 0 O-C-N 123.244 0.34 . . . . 0.0 110.563 -179.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -50.68 -37.96 44.08 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.785 178.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -133.52 137.29 45.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.305 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.2 t -62.21 -42.36 99.22 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.127 -178.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -59.32 -44.29 92.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.425 0.631 . . . . 0.0 110.043 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -56.78 -44.05 81.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.088 178.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 51.8 t -58.93 -39.01 80.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.551 177.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -59.09 -46.19 88.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.8 0.333 . . . . 0.0 110.566 -177.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.9 mtm105 -61.4 -49.92 74.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.745 -177.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 28.1 mm -58.54 -43.88 88.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.033 0.444 . . . . 0.0 109.955 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 57.3 p -59.81 -44.25 94.1 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.674 -177.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.54 -43.91 93.99 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 -178.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.5 mt -58.8 -48.67 80.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.142 0.496 . . . . 0.0 110.508 -178.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 54.7 t -59.0 -42.85 87.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.146 -178.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -57.36 -42.66 82.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.915 0.388 . . . . 0.0 110.566 -178.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.68 -43.54 99.12 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.243 -0.743 . . . . 0.0 111.243 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.7 mt -60.76 -42.2 96.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.801 0.334 . . . . 0.0 110.832 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 81.0 mt -62.38 -44.15 97.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.139 -177.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 24.8 pttt -78.46 -21.25 49.35 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -177.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 67.2 m -104.99 148.37 26.79 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.758 0.313 . . . . 0.0 110.521 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 80.5 tttt . . . . . 0 C--O 1.219 -0.521 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.541 179.822 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.353 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.77 142.6 25.01 Favored 'Trans proline' 0 N--CA 1.496 1.646 0 CA-C-N 118.859 1.329 . . . . 0.0 112.037 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -104.36 149.8 25.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.489 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -64.81 153.13 88.84 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.512 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -85.43 86.76 1.02 Allowed 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 121.553 1.502 . . . . 0.0 112.288 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 29.8 tp -58.16 -41.57 84.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.52 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.5 mt -102.86 139.75 38.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.477 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -137.43 166.34 24.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.599 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -56.82 -40.21 75.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.749 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -87.99 178.41 6.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.656 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 95.2 mtt-85 -57.69 141.4 48.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.568 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -77.9 158.53 77.69 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.476 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -66.23 133.22 32.13 Favored 'Trans proline' 0 N--CA 1.496 1.655 0 C-N-CA 121.275 1.317 . . . . 0.0 111.875 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -149.98 159.69 35.1 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.538 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -57.9 129.0 31.17 Favored 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 121.124 1.216 . . . . 0.0 111.741 -178.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 99.27 -5.05 58.84 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-O 119.484 -0.62 . . . . 0.0 113.443 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -92.1 151.6 20.34 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 118.271 1.036 . . . . 0.0 110.596 178.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 3.5 ttp -65.52 120.56 69.19 Favored Pre-proline 0 CA--C 1.536 0.41 0 CA-C-O 118.487 -0.768 . . . . 0.0 110.279 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -50.34 147.86 15.63 Favored 'Trans proline' 0 N--CA 1.498 1.777 0 CA-C-N 120.488 1.21 . . . . 0.0 111.827 178.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 21.3 m120 -100.51 123.04 44.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.586 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 14.6 mt -90.6 148.92 39.75 Favored Pre-proline 0 C--N 1.33 -0.273 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 179.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -79.14 139.7 15.18 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 C-N-CA 121.177 1.252 . . . . 0.0 111.366 174.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -97.17 125.94 43.95 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-O 118.463 -0.78 . . . . 0.0 109.628 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo -78.1 161.58 29.4 Favored 'Trans proline' 0 N--CA 1.496 1.656 0 C-N-CA 121.187 1.258 . . . . 0.0 111.929 178.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -49.91 157.0 2.94 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 C-N-CA 121.345 1.363 . . . . 0.0 111.838 177.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 81.2 mt -49.98 -23.56 2.08 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -177.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -58.33 -36.34 73.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.702 0.286 . . . . 0.0 111.497 -176.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 49.1 t90 -65.06 -48.4 73.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.685 -0.234 . . . . 0.0 111.061 -173.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -70.84 -40.13 72.56 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.881 -176.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -61.05 -46.27 91.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.858 0.361 . . . . 0.0 110.578 -179.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -59.83 -47.75 84.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.616 -176.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.07 -47.79 83.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.981 0.419 . . . . 0.0 110.773 -177.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -60.56 -44.75 95.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.319 -175.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 54.9 mmtt -65.41 -47.07 77.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.373 -177.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -55.46 -48.94 73.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.195 -177.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 43.4 tp10 -65.03 -36.99 86.14 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.141 179.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -79.27 154.63 29.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.817 0.342 . . . . 0.0 110.561 -179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 78.3 mt . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 118.022 -0.989 . . . . 0.0 110.587 179.857 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.398 0 N-CA-C 110.607 -0.997 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -66.11 -34.31 37.64 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 CA-C-N 119.319 1.56 . . . . 0.0 111.981 -175.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -96.06 -42.55 8.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.526 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 72.2 mtm -108.97 147.4 32.32 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.493 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -85.05 127.95 34.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.584 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -59.97 -38.72 83.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.935 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 79.2 mt -55.95 -39.53 71.86 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.957 -179.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 72.0 mtm -95.92 140.49 30.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.581 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.92 143.43 28.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.571 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -71.41 136.91 47.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.656 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.8 mp0 -69.5 -34.93 75.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.451 -179.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.5 m -57.01 -41.91 79.36 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.876 0.37 . . . . 0.0 110.571 -177.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.9 mm -60.34 -45.11 96.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.133 -178.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.3 m -59.21 -44.75 92.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.924 0.392 . . . . 0.0 110.561 -177.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -60.12 -45.64 92.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.482 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 66.2 mtt -58.13 -42.43 85.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.992 0.425 . . . . 0.0 110.457 -178.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -60.93 -50.52 73.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.251 -178.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 13.1 tp -59.84 -30.34 68.88 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.794 -0.363 . . . . 0.0 111.32 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.3 -51.99 60.72 Favored 'General case' 0 C--N 1.332 -0.153 0 O-C-N 122.161 -0.337 . . . . 0.0 110.754 178.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.65 -40.83 80.17 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.027 0.441 . . . . 0.0 110.553 179.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 93.9 mt -54.12 -53.01 31.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.608 178.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -51.9 -25.19 7.52 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -178.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -59.26 -34.37 72.16 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -177.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.5 mm -106.53 -44.79 7.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.112 0.482 . . . . 0.0 109.938 -177.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -117.2 77.49 9.57 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.628 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -55.05 -20.66 24.3 Favored 'Trans proline' 0 N--CA 1.497 1.704 0 C-N-CA 121.491 1.461 . . . . 0.0 113.631 -174.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.3 p90 -89.03 2.06 54.61 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -174.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -78.59 130.23 35.69 Favored 'General case' 0 C--O 1.231 0.093 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 175.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -108.84 -39.25 5.39 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.025 -174.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.3 tt0 -131.63 146.03 51.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.995 0.426 . . . . 0.0 111.137 -175.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 58.7 mt -100.54 132.07 46.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.681 172.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.1 t -91.59 -47.12 14.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.098 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -157.22 157.51 34.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.953 178.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 64.2 p -143.64 132.24 22.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.119 0.485 . . . . 0.0 111.234 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.6 t -107.05 126.59 52.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.551 176.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.6 m -54.54 -38.87 67.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.313 -172.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -149.81 126.6 11.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.119 0.485 . . . . 0.0 111.68 -178.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 93.8 t -145.22 140.53 22.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.09 -0.959 . . . . 0.0 109.531 -177.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.56 149.84 51.15 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.684 0.278 . . . . 0.0 111.203 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -98.5 131.03 45.07 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.365 0.602 . . . . 0.0 111.798 -176.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -127.5 140.41 52.16 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.199 177.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.3 m -121.66 145.49 47.95 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -109.15 131.0 55.48 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.913 0.387 . . . . 0.0 110.344 177.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -101.94 115.21 30.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.835 176.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 85.4 p -68.71 -31.35 70.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.998 -0.547 . . . . 0.0 112.015 -177.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.1 m -62.44 -37.81 87.32 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.652 0.263 . . . . 0.0 111.076 -178.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -95.59 -21.45 18.23 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -178.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 54.8 t30 69.4 46.08 0.79 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.524 0.678 . . . . 0.0 109.425 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 74.5 tt0 -155.06 151.46 28.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.058 -177.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 85.6 m95 -88.18 141.85 28.23 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.307 176.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -121.93 129.01 52.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.881 176.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -74.53 136.92 42.15 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 178.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 71.5 p -92.3 169.88 10.24 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.188 -178.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.4 p-10 -83.12 11.13 6.78 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.8 t -101.62 106.47 19.7 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-O 120.934 0.397 . . . . 0.0 110.287 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -131.51 111.37 11.71 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 175.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.63 176.57 38.94 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.015 -1.088 . . . . 0.0 112.307 -168.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -80.6 134.9 35.97 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 174.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -99.21 128.37 45.33 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 -176.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -132.52 143.05 49.48 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.341 177.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 68.9 mt -101.59 127.71 54.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 172.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 15.3 m-30 -108.44 138.29 44.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.845 0.355 . . . . 0.0 111.608 -176.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 64.1 t60 -114.66 143.37 45.14 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.283 174.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 29.3 ttp180 -141.46 152.35 44.15 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.481 177.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -86.95 28.19 0.93 Allowed 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.844 -0.617 . . . . 0.0 112.14 -178.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -155.45 152.15 28.64 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -63.98 133.51 95.61 Favored Pre-proline 0 CA--C 1.541 0.598 0 CA-C-O 118.456 -0.783 . . . . 0.0 110.323 -176.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -68.29 140.85 57.98 Favored 'Cis proline' 0 N--CA 1.498 1.746 0 CA-C-N 121.672 1.633 . . . . 0.0 111.409 -0.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -66.61 -38.78 87.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.253 -176.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -141.44 141.11 33.72 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.683 0.754 . . . . 0.0 111.122 -176.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.6 t -149.8 151.31 33.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.912 -178.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 50.4 mt -109.82 140.46 28.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -131.79 142.11 49.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.578 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 58.9 mt -123.49 128.62 74.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.186 0.517 . . . . 0.0 109.894 172.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -94.07 99.54 11.82 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.171 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -75.45 106.85 7.2 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.65 0.594 . . . . 0.0 111.045 -174.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -72.45 -43.49 63.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.565 -171.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 67.3 mt -70.8 -45.17 65.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.731 -174.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 37.2 m-20 -95.09 -3.29 48.38 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -175.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.3 p 50.35 42.29 25.76 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.511 0.672 . . . . 0.0 111.257 177.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.5 m -127.16 145.93 50.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.232 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 97.5 p -88.24 132.64 34.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.248 -178.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -123.07 122.26 38.05 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 174.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.3 t -125.42 148.0 30.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 120.764 0.316 . . . . 0.0 110.946 -175.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -148.73 126.48 5.73 Favored Pre-proline 0 CA--C 1.539 0.552 0 CA-C-O 118.678 -0.677 . . . . 0.0 110.495 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -75.49 151.0 36.87 Favored 'Trans proline' 0 N--CA 1.499 1.836 0 C-N-CA 121.408 1.405 . . . . 0.0 112.05 177.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 70.3 mt -91.44 112.29 25.18 Favored 'Isoleucine or valine' 0 C--O 1.231 0.125 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.472 179.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 66.0 p -98.94 153.34 18.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.842 175.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -96.59 32.5 6.47 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.355 -178.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.0 m -111.05 -19.13 12.86 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 173.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.9 mt -68.81 145.69 53.53 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.914 0.388 . . . . 0.0 111.452 -175.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 54.8 tt0 -111.76 136.12 51.46 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.819 175.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 64.2 mt -110.97 158.64 18.55 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.709 -177.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -149.52 142.95 25.3 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.1 t -100.38 109.18 21.34 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.476 179.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 23.7 mm-40 -106.61 103.67 47.52 Favored Pre-proline 0 C--N 1.329 -0.296 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 173.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -67.5 141.15 54.64 Favored 'Trans proline' 0 N--CA 1.497 1.724 0 CA-C-N 120.512 1.219 . . . . 0.0 111.919 -171.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -90.6 11.14 59.37 Favored 'Cis proline' 0 N--CA 1.499 1.818 0 CA-C-N 121.173 1.455 . . . . 0.0 113.667 -5.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -92.3 170.33 9.88 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.516 0.326 . . . . 0.0 110.67 -176.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 56.2 tp -115.59 134.48 55.02 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 173.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 12.0 tp -127.58 140.23 52.25 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 -173.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -148.17 155.52 41.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.849 0.357 . . . . 0.0 110.477 175.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.2 mtm105 -104.71 147.97 27.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.947 -176.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -128.67 167.34 17.36 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.944 0.878 . . . . 0.0 111.339 -178.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -47.77 148.48 1.55 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.195 -0.912 . . . . 0.0 112.188 -177.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 62.82 30.96 16.65 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.134 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.2 p 65.34 35.33 7.61 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.758 0.313 . . . . 0.0 111.638 166.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 68.5 mtp180 -98.0 147.21 24.73 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 76.9 mt -111.65 127.05 69.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 -177.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -134.26 147.96 50.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.451 -179.117 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.39 166.43 26.81 Favored Glycine 0 CA--C 1.524 0.652 0 C-N-CA 120.901 -0.666 . . . . 0.0 111.621 -178.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -125.27 140.78 52.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.24 -0.48 . . . . 0.0 110.213 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 83.9 t90 -107.42 128.98 54.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.652 175.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -115.46 144.24 44.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.806 0.336 . . . . 0.0 110.76 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -52.1 -35.92 49.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.568 177.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -135.44 135.69 40.75 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.814 0.34 . . . . 0.0 110.487 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.7 t -62.58 -42.32 99.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.188 -177.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -59.44 -43.88 93.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.412 0.625 . . . . 0.0 110.099 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -56.42 -45.55 80.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.077 179.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 41.3 t -60.47 -38.59 84.71 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.858 178.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -59.14 -45.57 90.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.829 0.347 . . . . 0.0 110.488 -177.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 -60.58 -48.52 81.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.574 -178.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 28.5 mm -58.24 -44.94 89.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.044 0.45 . . . . 0.0 109.982 -178.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 57.8 p -59.35 -44.01 92.73 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.692 -177.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.62 -43.96 94.11 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.7 mt -58.74 -48.6 80.62 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.136 0.493 . . . . 0.0 110.502 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 48.9 t -58.73 -44.12 89.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.141 -178.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 31.3 m120 -58.51 -41.9 86.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.828 -178.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.58 -42.94 99.64 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 111.411 -0.676 . . . . 0.0 111.411 -178.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 47.5 mt -63.29 -43.0 99.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.801 0.334 . . . . 0.0 111.172 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 25.4 mt -64.65 -44.91 88.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.591 -176.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 12.4 pttp -71.88 -37.56 70.15 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.522 -176.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 29.3 t -139.92 153.46 46.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.933 0.397 . . . . 0.0 110.779 -178.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 36.8 tttp . . . . . 0 C--O 1.221 -0.446 0 CA-C-O 117.926 -1.035 . . . . 0.0 110.738 -179.805 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.339 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -68.96 144.03 56.85 Favored 'Trans proline' 0 N--CA 1.496 1.655 0 C-N-CA 121.318 1.346 . . . . 0.0 111.878 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -97.78 118.34 34.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.569 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -83.16 154.75 67.06 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.548 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -86.94 30.63 0.47 Allowed 'Trans proline' 0 N--CA 1.491 1.357 0 C-N-CA 121.704 1.602 . . . . 0.0 112.499 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 78.1 mt -60.59 -39.06 86.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.883 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 27.2 tp -87.94 133.19 33.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.6 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -75.96 140.65 42.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.617 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -60.27 -39.77 88.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.875 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -94.8 120.79 35.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.668 -179.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 41.6 ttt85 -113.12 135.22 54.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.301 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -100.16 155.81 35.99 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.707 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -73.09 142.72 34.8 Favored 'Trans proline' 0 N--CA 1.494 1.558 0 C-N-CA 121.304 1.336 . . . . 0.0 111.897 179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 33.0 p90 -146.36 153.5 48.18 Favored Pre-proline 0 C--O 1.234 0.255 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.023 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.97 130.02 36.17 Favored 'Trans proline' 0 N--CA 1.495 1.56 0 C-N-CA 121.13 1.22 . . . . 0.0 111.543 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 105.0 -5.13 42.06 Favored Glycine 0 CA--C 1.533 1.209 0 CA-C-O 119.47 -0.628 . . . . 0.0 113.426 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -60.97 156.01 18.66 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 118.417 1.108 . . . . 0.0 110.246 174.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 5.5 ttt -61.16 118.15 33.31 Favored Pre-proline 0 CA--C 1.536 0.417 0 CA-C-O 118.497 -0.763 . . . . 0.0 110.38 -178.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -68.13 158.39 57.67 Favored 'Trans proline' 0 N--CA 1.497 1.702 0 C-N-CA 121.191 1.261 . . . . 0.0 111.755 177.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 42.4 t30 -91.57 110.51 21.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.622 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 26.6 mt -74.7 133.8 76.26 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 118.425 -0.797 . . . . 0.0 109.736 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -79.14 139.61 15.12 Favored 'Trans proline' 0 N--CA 1.494 1.532 0 CA-C-N 120.401 1.179 . . . . 0.0 111.16 174.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 26.3 mtmt -97.26 125.97 43.63 Favored Pre-proline 0 CA--C 1.535 0.384 0 CA-C-O 118.462 -0.78 . . . . 0.0 110.35 178.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -63.64 162.33 28.48 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 CA-C-N 120.697 1.284 . . . . 0.0 111.515 176.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -49.82 156.68 3.09 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 121.316 1.344 . . . . 0.0 111.739 178.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 82.0 mt -50.04 -28.81 7.6 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -176.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 64.0 t80 -55.69 -37.56 68.51 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.814 0.34 . . . . 0.0 111.205 -177.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 52.9 t90 -60.96 -48.13 83.26 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.425 -176.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -63.64 -48.89 75.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.035 0.445 . . . . 0.0 110.618 -178.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.29 -42.42 91.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.017 -176.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -59.37 -49.39 77.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.88 0.371 . . . . 0.0 110.592 -176.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.21 -49.44 77.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.771 -177.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -59.44 -40.97 88.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.331 -175.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 83.2 tttt -66.47 -48.11 70.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.364 -177.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -55.0 -49.07 72.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.233 -177.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -68.19 -35.4 77.94 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.42 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -63.96 143.48 57.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.825 0.345 . . . . 0.0 110.639 -178.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 6.6 tt . . . . . 0 C--O 1.221 -0.444 0 CA-C-O 117.96 -1.019 . . . . 0.0 110.496 179.718 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.316 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -51.48 -30.81 36.64 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 121.295 1.33 . . . . 0.0 112.309 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -56.26 -42.67 77.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.79 -179.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 85.2 mtp -111.32 144.73 40.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.501 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -146.75 152.58 39.04 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.57 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -85.13 112.61 20.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.573 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 78.9 mt -60.65 -41.5 95.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.623 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.5 mtm -141.13 136.35 31.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.602 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -115.53 151.94 33.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.462 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -132.09 107.41 8.62 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.47 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -61.52 -31.65 71.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.68 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.8 m -55.88 -40.48 73.05 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.932 0.396 . . . . 0.0 110.809 -177.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.3 mm -60.67 -47.72 91.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.13 -178.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.7 m -58.45 -43.43 88.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.466 -177.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -60.02 -45.76 91.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.644 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 89.7 mtp -58.21 -43.06 87.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.04 0.448 . . . . 0.0 110.448 -178.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -60.69 -50.16 74.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.298 -178.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.1 tp -60.66 -30.77 70.1 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.276 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.15 -50.7 69.38 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 122.276 -0.265 . . . . 0.0 110.601 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.97 -41.67 83.43 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.001 0.429 . . . . 0.0 110.424 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 94.4 mt -54.23 -52.94 33.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.594 178.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -53.95 -24.38 16.3 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -59.25 -33.22 70.76 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.0 mm -107.9 -42.09 5.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.765 0.317 . . . . 0.0 110.298 -177.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 35.9 t0 -115.11 85.47 12.42 Favored Pre-proline 0 CA--C 1.533 0.323 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.709 -175.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -53.75 -24.4 30.28 Favored 'Trans proline' 0 N--CA 1.497 1.709 0 C-N-CA 121.421 1.414 . . . . 0.0 113.319 -177.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.6 p90 -95.5 19.56 10.81 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 -175.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -101.94 118.21 36.43 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 172.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -112.98 -33.51 6.03 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -173.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -127.91 142.47 51.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.842 0.354 . . . . 0.0 110.684 -178.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 57.8 mt -99.43 129.78 49.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.827 173.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.9 t -90.57 -47.23 14.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.268 -0.423 . . . . 0.0 109.943 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -154.37 154.42 33.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.991 178.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 58.7 p -142.29 131.95 24.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.045 0.45 . . . . 0.0 111.009 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 38.5 t -107.58 126.61 52.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.682 177.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 86.7 p -54.59 -38.05 66.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.232 -172.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 61.0 t-80 -151.15 126.06 9.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.256 0.55 . . . . 0.0 111.523 -179.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 99.6 t -144.86 142.18 23.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.44 -178.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -130.53 149.76 52.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.09 -178.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -97.12 131.02 44.3 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.275 0.559 . . . . 0.0 111.588 -177.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -124.42 141.18 52.28 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.585 178.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 92.2 m -122.34 145.08 48.59 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 177.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -108.03 130.45 55.07 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 120.893 0.378 . . . . 0.0 110.313 177.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -101.29 114.86 29.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.784 176.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 27.1 m -67.49 -32.94 74.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.842 -177.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.0 m -61.47 -38.41 87.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.635 0.255 . . . . 0.0 111.006 -177.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -94.58 -21.5 18.8 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -178.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 25.8 t30 68.81 45.53 0.99 Allowed 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.426 0.631 . . . . 0.0 109.438 -177.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 78.2 tt0 -154.05 150.95 28.76 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.083 -176.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 89.4 m95 -86.51 142.02 28.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.255 176.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -125.04 134.09 52.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.34 -0.391 . . . . 0.0 109.99 176.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -75.53 140.95 43.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.287 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 62.6 p -92.39 172.36 8.44 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.066 178.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -83.86 12.61 5.84 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.9 t -108.41 106.49 20.79 Favored 'Isoleucine or valine' 0 C--O 1.231 0.123 0 CA-C-O 121.067 0.46 . . . . 0.0 110.43 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -129.96 112.63 13.69 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 173.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.61 176.49 38.93 Favored Glycine 0 CA--C 1.52 0.391 0 C-N-CA 120.192 -1.004 . . . . 0.0 112.354 -168.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.75 134.79 37.02 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 175.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -100.04 126.9 46.31 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.146 -175.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -131.52 142.16 49.89 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.767 0.318 . . . . 0.0 110.537 177.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 67.7 mt -101.68 126.72 55.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 172.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 14.0 m-30 -108.46 137.69 46.01 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.826 0.346 . . . . 0.0 111.343 -176.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 58.1 t60 -114.11 143.29 45.03 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.368 175.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.8 tpt180 -142.09 147.53 36.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.427 175.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.8 m120 -86.79 28.17 0.92 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.25 171.32 20.41 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -63.98 124.75 86.2 Favored Pre-proline 0 CA--C 1.539 0.535 0 CA-C-O 118.439 -0.791 . . . . 0.0 110.021 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -78.73 140.93 61.65 Favored 'Cis proline' 0 N--CA 1.498 1.746 0 CA-C-N 121.994 1.748 . . . . 0.0 111.906 -0.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -63.83 -46.53 84.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.096 -177.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -143.15 138.66 29.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.341 0.591 . . . . 0.0 110.992 -176.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.6 t -150.18 152.06 34.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.37 -178.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 50.8 mt -114.48 137.14 48.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 -178.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -131.91 142.19 49.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.537 -176.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 62.2 mt -120.4 129.93 75.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.2 0.524 . . . . 0.0 109.706 172.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -96.13 99.55 11.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.981 -1.009 . . . . 0.0 109.322 179.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.3 t-20 -71.79 106.28 4.09 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 123.669 0.605 . . . . 0.0 111.062 -174.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -74.01 -40.07 63.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.252 -171.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 72.9 mt -72.05 -45.19 61.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.648 -174.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 60.9 m-20 -95.11 -3.32 48.25 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 -175.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.3 m 55.6 43.18 28.66 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-O 121.493 0.663 . . . . 0.0 110.561 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.6 m -127.52 148.9 50.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.56 -177.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.9 p -99.2 135.36 40.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.322 -179.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -131.91 122.23 25.3 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.673 0.273 . . . . 0.0 110.266 175.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.7 p -125.54 149.88 30.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.094 -177.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 26.4 tp10 -147.36 133.95 9.88 Favored Pre-proline 0 CA--C 1.538 0.509 0 CA-C-O 118.861 -0.59 . . . . 0.0 110.302 174.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.42 150.94 37.1 Favored 'Trans proline' 0 N--CA 1.498 1.765 0 C-N-CA 121.54 1.494 . . . . 0.0 112.301 179.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 63.7 mt -89.47 139.5 17.36 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.19 177.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.1 p -132.09 156.88 45.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.867 177.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -98.16 37.71 3.37 Favored Glycine 0 CA--C 1.524 0.6 0 C-N-CA 121.0 -0.619 . . . . 0.0 111.832 -178.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 51.6 p -111.07 -23.19 11.06 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 174.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.8 mt -69.09 145.82 53.1 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.977 0.418 . . . . 0.0 111.502 -175.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 57.0 tt0 -113.66 135.92 53.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.556 175.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 68.9 mt -111.12 160.0 17.31 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.99 0.424 . . . . 0.0 110.978 -175.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -149.52 140.76 23.12 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.219 -0.659 . . . . 0.0 109.219 178.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.5 t -99.12 109.19 21.93 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.871 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -106.8 103.81 48.7 Favored Pre-proline 0 C--N 1.329 -0.307 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 172.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -71.67 139.87 34.77 Favored 'Trans proline' 0 N--CA 1.497 1.708 0 CA-C-N 120.501 1.215 . . . . 0.0 112.047 -171.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -88.99 9.49 64.49 Favored 'Cis proline' 0 N--CA 1.501 1.926 0 CA-C-N 121.22 1.471 . . . . 0.0 113.684 -4.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -84.61 170.41 13.4 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.775 0.321 . . . . 0.0 110.986 -177.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.1 tp -118.84 133.34 55.9 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 170.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.9 tp -126.01 141.01 52.14 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.538 0.209 . . . . 0.0 110.499 -174.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 15.3 p90 -147.4 156.37 42.82 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.799 0.333 . . . . 0.0 110.382 176.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.7 mtm105 -101.93 144.24 30.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.97 0.414 . . . . 0.0 110.734 -178.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -124.95 162.84 23.59 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.738 0.78 . . . . 0.0 111.446 -176.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -47.75 146.21 2.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.164 -177.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 65.36 30.92 10.81 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.067 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 43.1 t 66.17 35.19 6.24 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.863 0.363 . . . . 0.0 111.7 164.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.9 mtt-85 -102.93 152.76 20.94 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 81.4 mt -111.99 127.75 68.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-O 121.075 0.464 . . . . 0.0 109.813 -176.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 80.4 mtt180 -130.25 147.13 51.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.463 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -142.61 166.29 26.56 Favored Glycine 0 CA--C 1.523 0.537 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 -178.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -126.05 140.84 52.27 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.742 0.306 . . . . 0.0 110.749 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 13.5 t90 -108.5 128.27 54.65 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.608 175.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -117.54 144.22 45.32 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.769 0.319 . . . . 0.0 110.631 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -52.4 -36.79 54.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.582 178.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 39.1 t-20 -134.01 135.05 43.15 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.757 0.313 . . . . 0.0 110.511 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.3 p -61.92 -41.39 97.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.172 -177.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -60.69 -43.18 98.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.421 0.629 . . . . 0.0 110.159 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -56.53 -45.31 81.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.579 0.704 . . . . 0.0 109.99 178.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 42.1 t -60.01 -39.27 85.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.705 178.02 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -58.72 -44.91 90.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.907 0.384 . . . . 0.0 110.545 -177.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -60.25 -48.77 80.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.593 -177.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 31.0 mm -58.51 -45.45 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.064 0.459 . . . . 0.0 109.979 -178.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.5 p -59.7 -43.78 93.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.733 -177.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.72 -43.79 94.36 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 -178.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 10.3 mt -59.15 -48.92 79.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.054 0.454 . . . . 0.0 110.616 -178.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 58.7 t -59.21 -43.13 88.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.056 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 27.3 m120 -57.54 -42.55 83.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.6 -178.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.79 -45.44 96.21 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 -179.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 27.4 mt -58.56 -42.21 87.4 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.876 0.37 . . . . 0.0 110.594 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 80.6 mt -58.74 -41.0 85.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.638 179.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 34.5 pttt -95.93 11.16 34.86 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 33.3 t -132.03 142.93 49.72 Favored 'General case' 0 C--O 1.231 0.088 0 O-C-N 122.112 -0.367 . . . . 0.0 110.451 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 47.7 pttt . . . . . 0 C--O 1.219 -0.513 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.785 -179.786 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.383 0 N-CA-C 110.636 -0.986 . . . . 0.0 110.636 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -64.8 140.52 67.62 Favored 'Trans proline' 0 N--CA 1.496 1.618 0 CA-C-N 119.346 1.573 . . . . 0.0 111.924 -175.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -109.86 146.94 34.24 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.562 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -83.05 161.02 59.09 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.504 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -61.55 -30.58 86.37 Favored 'Trans proline' 0 N--CA 1.498 1.75 0 C-N-CA 121.244 1.296 . . . . 0.0 112.227 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 28.9 tp -56.31 -39.44 72.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.837 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.4 mt -79.79 148.32 31.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.481 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -69.32 140.96 54.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.593 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -58.65 -40.57 83.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.78 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -69.72 144.88 52.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.604 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 61.5 ttt180 -92.13 132.46 36.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.529 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -84.19 156.27 63.3 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.561 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -66.49 143.14 68.02 Favored 'Trans proline' 0 N--CA 1.496 1.638 0 C-N-CA 121.246 1.297 . . . . 0.0 111.796 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -129.06 99.89 21.31 Favored Pre-proline 0 CA--C 1.533 0.301 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.526 -179.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -57.89 128.92 30.83 Favored 'Trans proline' 0 N--CA 1.496 1.624 0 C-N-CA 121.05 1.167 . . . . 0.0 111.615 177.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 88.13 7.8 72.96 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 121.202 -0.523 . . . . 0.0 113.299 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -53.2 148.62 8.14 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 118.239 1.019 . . . . 0.0 111.185 178.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 19.7 ttp -61.09 144.89 90.45 Favored Pre-proline 0 CA--C 1.534 0.33 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.204 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 25.9 Cg_exo -60.94 148.83 91.42 Favored 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 121.244 1.296 . . . . 0.0 111.424 175.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -102.3 99.9 10.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.683 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 12.0 mt -66.27 150.56 96.87 Favored Pre-proline 0 C--N 1.329 -0.288 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.1 139.74 15.28 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 C-N-CA 121.09 1.193 . . . . 0.0 111.257 175.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 12.1 mmmt -97.13 125.74 44.74 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-O 118.783 -0.627 . . . . 0.0 110.011 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -74.2 155.22 46.91 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 121.396 1.397 . . . . 0.0 111.565 172.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -50.66 157.02 3.83 Favored 'Trans proline' 0 N--CA 1.495 1.569 0 C-N-CA 121.236 1.291 . . . . 0.0 111.721 178.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 82.4 mt -50.04 -26.93 4.84 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 57.1 t80 -55.15 -38.13 67.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.892 0.377 . . . . 0.0 111.086 -177.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 46.3 t90 -61.12 -48.04 83.49 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.298 -177.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -60.07 -46.87 88.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.97 0.414 . . . . 0.0 110.421 -177.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -60.41 -43.75 96.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.955 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -59.14 -45.59 90.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.773 -177.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -62.59 -52.91 61.54 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.858 -176.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -61.15 -35.72 77.85 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.482 -176.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 22.8 ttpt -66.05 -49.75 66.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.707 0.289 . . . . 0.0 111.016 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -55.33 -44.49 75.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.04 -178.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 42.8 tp10 -64.86 -37.11 86.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.994 178.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -75.5 143.93 42.27 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.784 0.326 . . . . 0.0 110.542 179.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 25.4 tp . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.563 179.997 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -64.27 -30.78 63.98 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 CA-C-N 119.22 1.51 . . . . 0.0 112.231 -175.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -56.0 -39.97 72.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.898 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 65.2 mtt -94.31 149.39 21.29 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.682 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -142.11 157.18 45.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.442 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 18.4 p30 -94.04 154.6 17.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.727 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 6.6 mp -67.39 -40.31 85.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.754 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.6 mtp -95.0 136.07 35.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.562 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.59 128.82 44.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.536 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -83.68 147.45 27.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.577 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -60.3 -35.34 75.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.281 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.8 t -57.16 -42.91 81.98 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.043 0.449 . . . . 0.0 110.507 -177.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.4 mm -59.69 -44.53 93.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.18 -178.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.3 m -59.48 -44.97 92.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.449 -177.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -59.55 -45.27 92.31 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.52 -178.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 88.5 mtp -58.22 -43.68 87.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.02 0.438 . . . . 0.0 110.421 -178.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -60.32 -49.22 78.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.269 -178.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.7 tp -59.16 -33.85 71.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.972 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.37 -50.54 69.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.546 0.212 . . . . 0.0 110.875 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.01 -42.13 84.57 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.976 0.417 . . . . 0.0 110.441 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 94.8 mt -54.22 -52.92 33.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.7 178.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -51.54 -25.13 6.15 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -178.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.5 tptp -57.84 -35.52 71.02 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.603 0.24 . . . . 0.0 111.469 -178.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.3 mm -103.92 -47.88 10.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.119 0.485 . . . . 0.0 109.792 -178.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -117.57 79.18 12.16 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.043 -176.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -54.72 -20.59 22.31 Favored 'Trans proline' 0 N--CA 1.498 1.746 0 C-N-CA 121.545 1.497 . . . . 0.0 113.695 -175.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 19.5 p90 -90.41 5.45 47.45 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -174.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -80.72 125.12 29.65 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 173.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 79.7 tttt -104.59 -39.51 6.35 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.814 -0.354 . . . . 0.0 111.124 -172.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -134.41 146.33 49.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.956 0.408 . . . . 0.0 111.27 -175.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 21.1 mt -100.87 133.65 43.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 172.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.7 t -92.39 -47.19 14.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.936 179.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -152.07 154.18 35.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.068 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.4 p -141.82 132.02 24.87 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.01 0.433 . . . . 0.0 110.748 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.7 t -107.4 128.98 54.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.737 176.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 87.3 p -54.58 -37.87 66.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.302 -172.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -152.74 127.34 9.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.231 0.539 . . . . 0.0 111.702 -178.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 97.5 t -145.27 141.82 22.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 114.97 -1.014 . . . . 0.0 109.521 -177.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.92 149.9 51.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.041 -178.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -100.72 131.64 46.51 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.278 0.561 . . . . 0.0 111.597 -177.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -126.5 144.73 50.77 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.826 179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 84.2 m -122.71 147.94 45.89 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 177.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -108.84 132.0 54.44 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.983 0.421 . . . . 0.0 110.379 176.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.9 t-20 -104.1 114.76 29.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.779 177.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.9 m -67.7 -32.71 73.54 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.969 -176.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.0 t -60.37 -39.71 88.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.757 0.313 . . . . 0.0 110.904 -177.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -94.09 -21.41 19.14 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 69.37 43.97 0.99 Allowed 'General case' 0 C--O 1.232 0.139 0 CA-C-O 121.419 0.628 . . . . 0.0 109.703 -177.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -150.02 163.46 38.08 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.165 -177.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -96.43 139.77 32.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.25 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -123.69 130.28 52.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.083 176.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -75.27 142.48 43.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.0 178.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.9 p -92.33 177.21 6.21 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.719 -0.393 . . . . 0.0 110.07 179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -86.93 13.6 8.79 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.4 t -109.48 106.39 20.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 120.928 0.394 . . . . 0.0 110.619 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -129.95 111.55 12.65 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 173.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.64 176.51 38.95 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 120.261 -0.971 . . . . 0.0 112.256 -168.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.53 136.72 37.63 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 175.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -101.64 126.16 48.43 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.27 -175.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -129.88 142.25 50.69 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.817 0.341 . . . . 0.0 110.402 177.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 67.5 mt -101.61 127.02 55.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 172.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 16.1 m-30 -108.55 139.66 43.01 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.929 0.395 . . . . 0.0 111.516 -176.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -113.13 143.34 44.52 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.014 174.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 30.0 ttp180 -141.13 152.86 45.06 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.59 178.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -86.89 28.11 0.93 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.164 -178.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -155.3 152.35 29.1 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -63.98 133.78 95.71 Favored Pre-proline 0 CA--C 1.541 0.598 0 CA-C-O 118.49 -0.767 . . . . 0.0 110.252 -176.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -68.35 140.91 58.55 Favored 'Cis proline' 0 N--CA 1.499 1.797 0 CA-C-N 121.702 1.644 . . . . 0.0 111.437 -1.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -63.64 -38.72 92.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.189 -177.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -141.06 141.85 34.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.611 0.719 . . . . 0.0 111.086 -176.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.2 t -149.54 152.16 35.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.922 -178.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 54.0 mt -113.03 138.66 41.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 -177.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -131.79 142.09 49.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.146 -177.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.1 mt -121.11 130.55 74.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-O 121.275 0.559 . . . . 0.0 109.815 172.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -96.44 99.58 11.23 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.269 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.7 t-20 -72.16 107.12 4.66 Favored 'General case' 0 C--N 1.332 -0.176 0 O-C-N 123.58 0.55 . . . . 0.0 111.192 -174.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.6 mtm105 -74.51 -39.8 62.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.387 -171.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 56.7 mt -74.2 -45.17 50.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.475 -175.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 39.4 t-20 -95.05 -3.23 48.63 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -175.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 63.3 p 51.52 42.54 29.53 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.479 0.656 . . . . 0.0 110.959 178.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.6 m -124.37 148.92 47.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.201 -179.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 11.2 p -98.97 134.7 41.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.281 -178.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -131.39 122.15 25.83 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.33 175.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.5 p -125.58 149.76 30.49 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.008 -178.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -149.04 132.13 8.18 Favored Pre-proline 0 CA--C 1.538 0.511 0 CA-C-O 118.834 -0.603 . . . . 0.0 110.493 175.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.45 150.92 36.96 Favored 'Trans proline' 0 N--CA 1.499 1.816 0 C-N-CA 121.552 1.501 . . . . 0.0 112.276 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 66.1 mt -90.81 123.39 42.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.143 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.393 178.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 80.6 p -98.79 163.27 12.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.993 176.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -97.82 15.88 61.13 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 120.861 -0.685 . . . . 0.0 113.265 -178.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 40.7 p -111.0 2.1 17.82 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 117.746 0.773 . . . . 0.0 112.956 176.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.3 mt -69.49 141.07 54.01 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 118.077 0.399 . . . . 0.0 111.192 -177.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -113.99 135.8 53.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.739 175.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 67.2 mt -119.38 158.34 26.35 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.986 0.422 . . . . 0.0 111.121 -175.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -149.68 141.53 23.73 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 176.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.0 t -105.69 109.17 21.04 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.196 -178.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -106.77 103.66 47.98 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 118.306 -0.854 . . . . 0.0 108.757 170.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.73 143.75 62.95 Favored 'Trans proline' 0 N--CA 1.499 1.81 0 CA-C-N 120.6 1.25 . . . . 0.0 111.955 -171.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -90.72 14.46 50.44 Favored 'Cis proline' 0 N--CA 1.501 1.916 0 CA-C-N 121.016 1.398 . . . . 0.0 113.518 -3.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -94.55 161.87 14.03 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 122.36 0.264 . . . . 0.0 110.411 -178.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 46.9 tp -114.93 132.89 56.4 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 172.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 8.6 tp -122.73 139.42 53.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.282 -173.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 48.7 p90 -142.93 154.62 44.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.826 0.346 . . . . 0.0 110.488 175.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.2 mtm180 -101.78 145.76 28.71 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.7 -178.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -127.68 164.77 21.35 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.659 0.743 . . . . 0.0 111.534 -176.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -47.2 145.62 2.2 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.171 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 12.4 tpt180 65.28 30.91 10.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.322 -0.854 . . . . 0.0 112.019 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.0 t 64.93 35.27 8.41 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.896 0.379 . . . . 0.0 111.527 166.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 50.6 mtm180 -98.25 150.63 21.32 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 179.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 74.2 mt -114.66 127.53 72.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 -178.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -140.14 150.39 44.19 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.612 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.7 169.32 26.08 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 120.965 -0.636 . . . . 0.0 111.634 -175.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -125.22 137.3 54.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.389 -0.405 . . . . 0.0 110.4 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 42.7 t90 -107.18 127.53 53.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.6 176.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -114.54 146.15 41.09 Favored 'General case' 0 C--N 1.329 -0.294 0 O-C-N 123.223 0.327 . . . . 0.0 110.509 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -51.57 -36.35 44.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.627 177.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -134.08 134.85 42.79 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.416 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.7 t -61.2 -41.81 97.48 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.988 -177.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -59.88 -43.02 94.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.359 0.599 . . . . 0.0 110.176 179.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -56.98 -44.54 82.76 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.937 178.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 43.3 t -59.98 -38.71 83.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.698 177.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -59.1 -46.05 89.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.876 0.369 . . . . 0.0 110.502 -177.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 60.6 ttm-85 -59.79 -48.71 80.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.053 0.454 . . . . 0.0 110.579 -178.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 30.1 mm -58.33 -44.56 88.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.052 -179.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 53.3 p -59.4 -44.2 92.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.649 -177.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.78 -44.59 94.14 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 -178.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 10.4 mt -58.73 -48.34 81.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.114 0.483 . . . . 0.0 110.553 -178.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 50.6 t -58.9 -43.41 88.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.078 -178.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -57.4 -42.43 82.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.636 -178.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.33 -45.3 96.73 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.954 -0.858 . . . . 0.0 110.954 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.6 mt -57.82 -42.69 84.79 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.93 0.395 . . . . 0.0 110.524 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 86.9 mt -59.39 -41.73 90.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.636 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 15.0 pttm -95.5 11.22 33.74 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 67.5 m -119.95 145.73 46.48 Favored 'General case' 0 C--O 1.232 0.144 0 O-C-N 122.141 -0.349 . . . . 0.0 110.39 179.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 85.3 tttt . . . . . 0 C--O 1.219 -0.51 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.686 -179.645 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.364 0 N-CA-C 110.653 -0.979 . . . . 0.0 110.653 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -64.07 144.56 87.7 Favored 'Trans proline' 0 N--CA 1.496 1.648 0 CA-C-N 119.303 1.552 . . . . 0.0 111.906 -175.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -124.14 153.96 40.75 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.503 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -74.18 159.08 84.68 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.571 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -70.01 86.43 0.62 Allowed 'Trans proline' 0 N--CA 1.495 1.567 0 C-N-CA 121.24 1.293 . . . . 0.0 111.952 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 77.8 mt -62.74 -37.59 87.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.163 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 27.6 tp -75.9 132.55 40.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.872 0.368 . . . . 0.0 110.771 -178.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -115.3 151.8 33.9 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.229 178.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -60.58 -46.5 89.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.891 -178.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -148.98 160.26 43.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.666 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 93.0 mtm-85 -113.15 133.88 54.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.35 179.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.57 162.59 19.42 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.611 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -49.66 144.09 20.55 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 121.268 1.312 . . . . 0.0 112.015 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 53.2 m-85 -116.61 99.82 53.05 Favored Pre-proline 0 C--O 1.235 0.293 0 CA-C-O 119.125 -0.464 . . . . 0.0 110.53 -179.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -60.39 128.96 27.79 Favored 'Trans proline' 0 N--CA 1.496 1.657 0 C-N-CA 121.0 1.133 . . . . 0.0 111.355 178.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 99.79 -5.06 58.04 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 121.098 -0.572 . . . . 0.0 113.353 -178.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -52.05 143.49 13.86 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 118.252 1.026 . . . . 0.0 111.35 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 4.6 ttt -61.07 132.73 92.4 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-O 118.704 -0.665 . . . . 0.0 110.276 -178.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.93 160.95 44.84 Favored 'Trans proline' 0 N--CA 1.495 1.615 0 C-N-CA 121.234 1.289 . . . . 0.0 111.523 174.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -96.07 110.21 22.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.81 -179.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 16.8 mt -62.57 154.72 72.3 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.147 178.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -79.03 139.86 15.47 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 C-N-CA 121.227 1.285 . . . . 0.0 110.841 173.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -95.66 125.72 48.13 Favored Pre-proline 0 CA--C 1.534 0.354 0 CA-C-O 118.803 -0.618 . . . . 0.0 109.667 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -77.95 154.03 29.43 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 121.446 1.431 . . . . 0.0 111.643 173.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -58.47 154.2 43.27 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 121.313 1.342 . . . . 0.0 111.404 177.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 6.2 mp -50.66 -30.5 13.73 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -176.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -55.88 -38.04 69.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.82 0.343 . . . . 0.0 111.188 -177.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 7.6 t90 -61.92 -48.06 82.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.151 -177.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -60.4 -47.06 87.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.113 0.483 . . . . 0.0 110.519 -177.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -59.93 -45.38 92.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.794 -177.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -57.81 -45.15 86.53 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.539 -177.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.21 -48.26 82.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.577 -178.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -57.76 -42.01 83.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.951 -177.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -64.01 -48.42 76.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.022 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -55.18 -45.75 75.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.077 -178.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 42.1 tp10 -65.03 -37.01 86.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.005 179.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -158.0 146.12 18.75 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.763 0.316 . . . . 0.0 110.612 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 31.1 tp . . . . . 0 C--O 1.219 -0.509 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.482 179.68 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -67.88 153.8 74.56 Favored 'Trans proline' 0 N--CA 1.495 1.564 0 C-N-CA 121.28 1.32 . . . . 0.0 112.008 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -55.92 -39.85 72.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.934 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 45.0 ttm -82.82 123.35 29.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.625 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -146.51 154.23 41.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.465 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 18.5 p30 -76.2 153.97 35.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.709 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 29.5 tp -69.29 -39.43 78.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.838 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.4 mtp -64.73 116.49 6.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.621 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -174.56 125.44 0.3 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.557 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -78.94 85.64 4.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.556 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -67.11 -33.35 75.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.596 -179.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 24.8 m -56.5 -41.07 76.06 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.919 0.39 . . . . 0.0 110.759 -176.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.7 mm -60.66 -46.44 95.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.287 -178.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.5 m -59.12 -43.93 91.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.519 -177.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -59.64 -45.89 90.64 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.607 -178.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 66.0 mtt -58.26 -43.68 88.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.027 0.442 . . . . 0.0 110.347 -178.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -60.34 -48.56 81.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.35 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.4 tp -60.79 -33.6 73.23 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.051 -178.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.59 -49.57 74.74 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.647 0.261 . . . . 0.0 110.673 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.99 -41.97 88.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.015 0.436 . . . . 0.0 110.501 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 92.9 mt -54.22 -53.01 32.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.535 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -53.47 -21.75 6.77 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -58.26 -34.85 70.94 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.584 0.23 . . . . 0.0 111.542 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.6 mm -113.05 -37.77 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 120.679 0.276 . . . . 0.0 110.815 -176.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.5 t0 -116.7 77.4 8.25 Favored Pre-proline 0 CA--C 1.536 0.416 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.469 -177.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -54.85 -20.41 22.39 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 121.505 1.47 . . . . 0.0 113.416 -177.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 44.9 p90 -92.8 15.9 13.63 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -174.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -89.68 124.69 34.82 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 173.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.9 mmtp -97.54 -40.52 8.6 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.827 -175.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -153.09 157.52 40.53 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.574 -0.45 . . . . 0.0 111.503 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 46.7 mt -95.36 138.45 21.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.068 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.5 t -91.4 -46.42 14.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.801 176.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -154.72 156.56 36.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.006 178.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.7 p -143.11 132.65 23.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.016 0.436 . . . . 0.0 110.986 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.7 t -108.79 128.08 54.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.869 177.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.3 m -54.62 -39.06 67.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.226 -172.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -151.53 126.61 9.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.223 0.535 . . . . 0.0 111.742 -178.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 97.5 t -145.19 140.38 22.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.472 -177.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.52 149.85 50.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.068 -178.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 21.7 t80 -101.45 130.14 47.63 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.289 0.566 . . . . 0.0 111.649 -176.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -124.91 142.46 51.45 Favored 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.687 178.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 72.1 m -122.07 147.47 46.07 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 177.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -104.79 131.94 51.64 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.018 0.437 . . . . 0.0 110.268 175.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -104.44 116.45 32.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.885 178.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 86.4 p -68.47 -31.62 71.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.966 -177.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -62.79 -38.34 90.29 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.986 -177.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -93.89 -21.48 19.21 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 69.08 42.48 1.25 Allowed 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.246 0.546 . . . . 0.0 109.948 -178.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -153.12 166.38 32.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.124 -177.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -90.78 142.01 28.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.236 177.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -125.06 127.53 47.08 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 176.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -72.39 139.79 48.02 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 177.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.6 p -92.19 178.62 5.8 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.035 -179.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -89.01 16.12 7.54 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.0 t -112.29 106.4 20.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-O 120.946 0.403 . . . . 0.0 110.557 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -129.75 111.25 12.46 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 173.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.67 176.61 38.97 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 120.112 -1.042 . . . . 0.0 112.157 -168.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.33 137.0 37.83 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 175.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -100.06 127.69 46.25 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.219 -176.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -130.78 142.9 50.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.653 0.263 . . . . 0.0 110.319 177.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 67.4 mt -101.5 127.77 54.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 172.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 16.2 m-30 -108.48 137.32 46.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.939 0.4 . . . . 0.0 111.262 -175.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -117.58 143.34 46.21 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.143 176.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 51.4 ttt85 -139.85 147.53 40.81 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.8 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -86.91 28.14 0.93 Allowed 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.6 157.74 32.54 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -63.88 135.27 96.22 Favored Pre-proline 0 CA--C 1.539 0.553 0 CA-C-O 118.571 -0.728 . . . . 0.0 110.208 -176.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -66.71 140.86 51.98 Favored 'Cis proline' 0 N--CA 1.5 1.869 0 CA-C-N 121.66 1.629 . . . . 0.0 111.275 -3.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -68.14 -42.9 79.45 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.163 -176.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 74.6 m80 -143.03 140.58 31.04 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.622 0.725 . . . . 0.0 111.057 -176.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.8 t -150.08 152.31 34.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.056 -177.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 46.3 mt -111.48 137.71 42.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -178.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -131.83 142.03 49.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.042 -176.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.0 mt -123.44 133.75 68.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.195 0.521 . . . . 0.0 109.872 172.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -101.45 99.93 10.32 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.556 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -72.62 109.0 5.95 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 123.655 0.597 . . . . 0.0 111.037 -175.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -74.4 -40.39 62.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.2 -171.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 54.7 mt -71.19 -45.0 64.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.613 -175.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 53.2 m-20 -95.1 -3.13 48.64 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -175.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.3 p 51.17 42.2 28.51 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.439 0.638 . . . . 0.0 111.092 178.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 42.9 m -127.96 149.07 50.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.153 -0.93 . . . . 0.0 109.729 179.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.0 p -102.28 144.99 30.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.923 0.392 . . . . 0.0 111.161 -177.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -138.38 122.16 17.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.301 177.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 p -125.43 148.38 29.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.53 -0.304 . . . . 0.0 111.061 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -146.44 136.46 11.96 Favored Pre-proline 0 CA--C 1.537 0.48 0 CA-C-O 118.992 -0.528 . . . . 0.0 110.507 175.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.4 150.92 37.14 Favored 'Trans proline' 0 N--CA 1.498 1.771 0 C-N-CA 121.615 1.544 . . . . 0.0 112.484 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 71.3 mt -90.51 137.26 21.97 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-O 120.916 0.389 . . . . 0.0 110.317 177.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.9 p -132.18 155.39 48.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.708 177.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -96.45 32.0 6.92 Favored Glycine 0 CA--C 1.527 0.789 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.331 -178.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 63.4 p -100.85 -26.01 13.91 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 173.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.9 mt -69.01 147.35 51.72 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 120.889 0.375 . . . . 0.0 111.317 -176.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -116.2 135.84 53.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.638 175.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.3 mt -109.18 159.64 16.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.208 -174.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -148.9 141.36 24.26 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 178.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.8 t -98.82 109.21 22.0 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.725 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -106.85 103.61 48.0 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 172.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -71.32 139.65 35.39 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 CA-C-N 120.613 1.255 . . . . 0.0 112.012 -171.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -89.36 9.48 64.28 Favored 'Cis proline' 0 N--CA 1.5 1.897 0 CA-C-N 121.267 1.488 . . . . 0.0 113.737 -3.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -84.99 170.72 12.74 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.72 0.295 . . . . 0.0 110.858 -177.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 61.8 tp -118.75 132.75 56.15 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 170.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.8 tp -124.16 140.06 53.33 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.538 0.208 . . . . 0.0 110.583 -173.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 20.5 p90 -145.72 149.89 35.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.851 0.358 . . . . 0.0 110.562 175.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 54.5 mtm180 -106.71 148.17 28.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 -177.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -129.56 165.02 22.55 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.837 0.827 . . . . 0.0 111.433 -176.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -47.92 148.15 1.77 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.219 -177.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 54.7 ttt180 65.33 30.8 10.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.019 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 31.8 m 65.19 35.24 7.93 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.795 0.331 . . . . 0.0 111.575 165.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -99.74 145.95 27.09 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 85.2 mt -113.7 130.36 67.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.114 0.483 . . . . 0.0 109.81 -178.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -137.91 147.71 44.65 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.433 177.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.91 168.16 25.73 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 111.373 -0.691 . . . . 0.0 111.373 -176.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -125.2 140.41 52.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.803 0.335 . . . . 0.0 110.803 -179.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 21.9 t90 -106.89 123.82 48.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.584 175.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -113.33 141.55 46.89 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.824 0.345 . . . . 0.0 110.519 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -51.31 -35.82 39.64 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.672 178.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 -135.57 135.98 40.74 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.33 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 82.7 p -63.39 -40.23 96.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.144 -177.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -60.65 -43.3 97.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.356 0.598 . . . . 0.0 110.096 178.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -56.73 -45.8 81.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.563 0.697 . . . . 0.0 109.928 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 47.7 t -60.09 -38.13 82.01 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.811 178.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -59.48 -46.6 88.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.863 0.363 . . . . 0.0 110.514 -177.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 72.2 mtm180 -60.07 -48.16 82.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.008 0.433 . . . . 0.0 110.646 -177.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 28.9 mm -58.42 -44.94 89.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.072 -178.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.2 p -59.31 -44.3 92.57 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.679 -177.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.48 -44.42 93.71 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -178.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.3 mt -58.59 -48.41 81.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.185 0.517 . . . . 0.0 110.471 -178.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 54.3 t -58.63 -43.52 87.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.185 -178.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.8 m120 -58.2 -42.66 86.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.745 -178.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.97 -42.94 99.77 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.409 -0.676 . . . . 0.0 111.409 -178.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 50.1 mt -64.1 -43.27 95.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.759 0.314 . . . . 0.0 111.303 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 24.0 mt -63.74 -45.01 91.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.385 -176.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -70.81 -38.18 73.28 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.826 -0.35 . . . . 0.0 111.168 -177.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 67.7 p -88.28 158.58 18.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.54 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt . . . . . 0 C--O 1.221 -0.438 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.571 179.922 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.299 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -50.71 141.74 34.03 Favored 'Trans proline' 0 N--CA 1.494 1.554 0 CA-C-N 118.802 1.301 . . . . 0.0 112.031 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -111.51 148.7 32.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.5 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -67.69 153.45 95.04 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.514 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -75.82 130.34 12.38 Favored 'Trans proline' 0 N--CA 1.494 1.554 0 C-N-CA 121.253 1.302 . . . . 0.0 112.072 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 79.7 mt -63.33 -40.24 96.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.709 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 6.8 mp -102.41 137.42 40.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.515 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -100.05 125.61 46.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.566 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.07 -40.07 84.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.828 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -95.23 137.56 34.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.561 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 25.8 mmt180 -103.62 132.51 49.81 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.399 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.57 164.48 14.64 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.491 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -49.26 151.9 6.01 Favored 'Trans proline' 0 N--CA 1.495 1.577 0 C-N-CA 121.326 1.351 . . . . 0.0 112.094 179.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -107.39 99.88 30.57 Favored Pre-proline 0 CA--C 1.534 0.345 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.516 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -57.91 128.97 31.03 Favored 'Trans proline' 0 N--CA 1.496 1.636 0 C-N-CA 121.054 1.169 . . . . 0.0 111.674 178.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 76.74 19.9 77.14 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.91 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -53.72 141.63 25.94 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 117.883 0.842 . . . . 0.0 111.087 177.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 8.3 ttt -65.93 118.06 48.36 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-O 118.703 -0.665 . . . . 0.0 110.574 -178.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -65.09 156.97 59.86 Favored 'Trans proline' 0 N--CA 1.498 1.74 0 C-N-CA 121.121 1.214 . . . . 0.0 111.397 172.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 38.9 t30 -97.36 110.59 23.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.932 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 11.6 mt -66.12 152.1 94.43 Favored Pre-proline 0 C--N 1.33 -0.26 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 177.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.1 139.61 15.18 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 121.083 1.189 . . . . 0.0 111.084 174.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -97.14 125.9 44.14 Favored Pre-proline 0 CA--C 1.535 0.396 0 CA-C-O 118.442 -0.789 . . . . 0.0 110.007 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -78.17 168.97 21.02 Favored 'Trans proline' 0 N--CA 1.496 1.643 0 C-N-CA 121.315 1.343 . . . . 0.0 111.734 176.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.91 152.55 57.12 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 C-N-CA 121.268 1.312 . . . . 0.0 111.344 177.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 6.1 mp -49.97 -25.23 3.12 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -176.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 84.9 m-85 -55.34 -37.65 67.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.742 0.306 . . . . 0.0 111.167 -176.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 58.2 t90 -61.78 -48.1 82.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.406 -176.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -62.01 -49.55 75.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.981 0.42 . . . . 0.0 110.52 -176.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -60.9 -46.05 92.18 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.083 -175.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 42.4 tp10 -59.29 -46.85 87.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.72 -175.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -61.58 -50.75 71.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.891 -176.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -59.43 -42.03 90.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.373 -175.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 82.4 tttt -68.04 -49.75 59.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.519 -176.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -58.52 -49.0 78.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.59 -175.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -73.07 -37.07 66.94 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.923 -0.311 . . . . 0.0 111.351 -177.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -124.64 127.39 47.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.8 0.333 . . . . 0.0 110.748 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 78.1 mt . . . . . 0 C--O 1.221 -0.427 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.543 179.852 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.298 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -86.92 30.54 0.47 Allowed 'Trans proline' 0 N--CA 1.491 1.359 0 C-N-CA 121.636 1.557 . . . . 0.0 112.514 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -59.12 -41.32 87.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.759 0.314 . . . . 0.0 110.593 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 85.4 mtp -88.75 143.51 26.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.594 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -99.07 145.54 27.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.544 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 77.1 m-20 -67.62 143.24 56.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.561 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 78.5 mt -57.98 -40.03 79.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.767 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.8 mtp -86.38 134.13 33.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.496 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -87.78 117.99 27.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.571 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -83.46 154.4 23.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.438 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -59.82 -38.74 82.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.839 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.0 p -57.7 -41.63 82.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.975 0.417 . . . . 0.0 110.435 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.2 mm -59.75 -44.14 93.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.108 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 32.7 m -59.44 -45.18 92.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.534 -177.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -59.05 -45.96 89.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.369 -178.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.5 mtt -58.14 -43.92 87.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.188 0.518 . . . . 0.0 110.387 -177.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -59.95 -49.46 77.61 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.189 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.8 tp -58.79 -33.69 70.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.988 -178.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.05 -50.94 68.65 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.659 0.266 . . . . 0.0 110.891 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.85 -41.55 82.61 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.967 0.413 . . . . 0.0 110.5 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 88.8 mt -54.31 -52.93 34.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.627 178.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -51.43 -24.17 4.67 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt -58.56 -34.11 70.68 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 -177.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 43.7 mm -110.22 -42.05 4.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.79 0.329 . . . . 0.0 110.239 -177.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -116.25 79.23 8.6 Favored Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.137 -178.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -53.86 -19.96 16.45 Favored 'Trans proline' 0 N--CA 1.497 1.717 0 C-N-CA 121.54 1.493 . . . . 0.0 113.498 -176.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.3 p90 -95.96 15.23 21.08 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -174.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -91.65 126.59 36.79 Favored 'General case' 0 C--N 1.333 -0.121 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 173.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.6 ttmt -109.34 -38.0 5.6 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 120.835 -0.346 . . . . 0.0 111.37 -172.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -132.81 145.54 51.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.962 0.41 . . . . 0.0 111.157 -175.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 19.2 mt -100.45 133.44 43.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 171.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.1 t -90.57 -47.06 14.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.987 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -153.82 156.08 37.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.994 179.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.7 p -142.57 132.05 23.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.102 0.477 . . . . 0.0 110.917 179.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.0 t -108.52 127.37 53.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.731 177.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 86.9 p -54.78 -38.24 67.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.28 -172.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -151.19 126.36 9.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.215 0.531 . . . . 0.0 111.764 -178.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 97.3 t -145.28 140.12 22.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.32 -177.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -130.22 149.85 51.73 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.17 -177.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -96.85 133.55 41.32 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.313 0.578 . . . . 0.0 111.638 -176.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -125.77 140.91 52.29 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.404 177.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 86.2 m -123.0 144.06 49.51 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 177.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -105.31 130.24 53.48 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.901 0.381 . . . . 0.0 110.155 175.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -101.56 115.52 30.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.785 176.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.5 m -67.48 -33.18 74.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.895 -177.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.3 m -61.54 -38.08 86.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.631 0.253 . . . . 0.0 111.021 -177.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -94.92 -21.37 18.69 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 22.5 t30 68.99 45.44 0.92 Allowed 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.519 0.676 . . . . 0.0 109.558 -177.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 74.5 tt0 -155.96 151.63 27.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.203 -177.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 88.8 m95 -84.32 142.46 30.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.123 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -125.02 131.49 53.38 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.01 -0.366 . . . . 0.0 110.01 176.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 55.8 pttt -74.87 136.79 41.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.277 178.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.4 p -92.31 168.46 11.3 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.775 -0.37 . . . . 0.0 110.285 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -74.22 -18.49 60.74 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.5 t -75.51 106.39 5.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-O 121.042 0.448 . . . . 0.0 110.457 -178.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -133.29 110.95 10.43 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 174.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.61 176.54 38.92 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 120.277 -0.963 . . . . 0.0 112.252 -168.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.39 135.48 37.45 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 174.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -99.12 127.48 45.08 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.134 -176.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -130.72 142.4 50.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.297 177.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 66.5 mt -101.54 127.51 54.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 172.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 16.8 m-30 -108.47 136.22 48.46 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.994 0.426 . . . . 0.0 111.394 -175.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 79.0 t60 -112.05 143.34 43.22 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.247 174.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -142.01 146.58 35.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.041 178.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -86.89 28.04 0.94 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.267 -0.424 . . . . 0.0 112.081 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.6 169.53 24.21 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -64.02 125.29 87.67 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-O 118.441 -0.79 . . . . 0.0 110.018 -178.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -78.39 141.0 63.19 Favored 'Cis proline' 0 N--CA 1.497 1.677 0 CA-C-N 121.92 1.721 . . . . 0.0 111.831 -1.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -64.9 -41.5 95.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.993 -177.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -142.71 136.97 29.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.365 0.602 . . . . 0.0 110.935 -177.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.1 t -150.55 152.35 34.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.38 -178.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 43.0 mt -111.15 138.44 39.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 -178.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -131.88 142.0 49.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.955 -176.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 62.8 mt -123.5 132.76 70.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.255 0.55 . . . . 0.0 109.784 172.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -99.15 99.52 10.52 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.234 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 56.8 t-20 -76.56 107.82 9.1 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 121.748 0.785 . . . . 0.0 110.86 -174.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 60.7 ttm-85 -73.41 -35.98 65.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.516 -170.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.6 mt -71.47 -45.35 62.78 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.999 -173.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 42.1 p-10 -95.2 -3.35 47.9 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -177.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.7 m 58.32 44.25 18.8 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.497 0.665 . . . . 0.0 109.97 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 29.3 m -134.35 149.06 50.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.224 -177.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 10.8 p -101.85 144.99 29.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.283 -177.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -137.31 122.24 18.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.444 177.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 13.0 p -125.42 149.22 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-O 120.933 0.397 . . . . 0.0 111.177 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -147.83 131.35 8.26 Favored Pre-proline 0 CA--C 1.538 0.513 0 CA-C-O 118.747 -0.644 . . . . 0.0 110.241 176.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -75.35 150.84 37.25 Favored 'Trans proline' 0 N--CA 1.5 1.872 0 C-N-CA 121.475 1.45 . . . . 0.0 112.432 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 62.5 mt -90.69 123.01 42.67 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-O 120.846 0.355 . . . . 0.0 110.488 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 73.0 p -99.66 154.61 18.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.869 174.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -92.69 24.14 25.1 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.868 -179.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 38.8 p -111.03 -9.91 14.38 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 175.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.9 mt -67.74 140.39 56.72 Favored 'General case' 0 C--O 1.232 0.142 0 O-C-N 122.112 -0.367 . . . . 0.0 111.275 -176.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.9 tt0 -113.48 135.81 53.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.853 176.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 61.3 mt -113.61 161.31 17.59 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.75 -176.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -149.99 143.71 25.37 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.3 t -99.69 109.25 21.73 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.515 179.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -106.75 103.75 48.29 Favored Pre-proline 0 C--N 1.329 -0.321 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 173.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -67.92 140.1 49.36 Favored 'Trans proline' 0 N--CA 1.496 1.647 0 CA-C-N 120.403 1.179 . . . . 0.0 111.784 -172.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -89.76 9.24 64.61 Favored 'Cis proline' 0 N--CA 1.5 1.899 0 CA-C-N 121.239 1.478 . . . . 0.0 113.699 -5.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -89.58 172.79 8.71 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.607 0.241 . . . . 0.0 110.815 -176.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.8 tp -115.95 136.38 53.1 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 172.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 11.6 tp -129.5 140.64 51.2 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.617 0.246 . . . . 0.0 110.654 -174.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -146.39 157.32 43.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.808 0.337 . . . . 0.0 110.418 175.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.4 mtm105 -101.88 144.79 30.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.629 -177.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -127.49 163.02 25.03 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.951 0.881 . . . . 0.0 111.854 -176.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -47.77 149.98 1.16 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.36 -0.837 . . . . 0.0 112.177 -177.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 93.0 mtt180 62.21 30.8 17.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.158 -0.928 . . . . 0.0 112.102 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 69.6 m 65.74 35.23 6.97 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.866 0.365 . . . . 0.0 111.487 165.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 68.1 mtp180 -101.23 151.37 21.94 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 78.5 mt -111.37 126.75 68.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 -178.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 32.9 mtp180 -130.82 145.35 51.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.658 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -140.84 167.98 25.44 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -127.96 141.71 51.45 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.952 0.406 . . . . 0.0 110.882 -178.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 70.8 t90 -106.72 124.67 49.95 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.518 175.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -114.01 140.43 48.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.677 0.275 . . . . 0.0 110.512 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 68.9 t80 -51.7 -36.72 47.84 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.665 178.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 37.3 t-20 -134.46 135.66 42.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.438 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.3 m -61.22 -42.05 97.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.07 -177.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -59.85 -43.4 94.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.399 0.619 . . . . 0.0 110.136 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -56.78 -44.87 82.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.49 0.662 . . . . 0.0 110.079 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 45.9 t -59.7 -39.83 85.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.673 178.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -58.79 -44.86 90.83 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.848 0.356 . . . . 0.0 110.669 -177.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -60.79 -49.79 76.07 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.73 -177.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 32.9 mm -58.47 -44.57 89.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.051 0.453 . . . . 0.0 109.982 -178.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 60.1 p -59.79 -44.16 94.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.677 -177.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.66 -43.69 94.28 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.67 -0.972 . . . . 0.0 110.67 -178.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.1 mt -59.18 -49.01 79.49 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.118 0.485 . . . . 0.0 110.617 -178.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 53.8 t -58.9 -43.51 88.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.083 -178.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -58.03 -42.52 85.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.865 0.364 . . . . 0.0 110.674 -178.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.97 -41.47 99.66 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 -179.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 36.3 mt -62.5 -43.16 99.5 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.878 0.371 . . . . 0.0 111.119 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 79.9 mt -64.14 -44.89 90.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.618 -176.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 49.4 pttt -70.84 -36.97 73.11 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.301 -177.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 55.0 p -62.44 162.88 9.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.776 0.322 . . . . 0.0 110.514 -179.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 99.3 mttt . . . . . 0 C--O 1.221 -0.442 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.5 -179.802 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.29 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.59 141.93 56.99 Favored 'Trans proline' 0 N--CA 1.495 1.612 0 C-N-CA 121.33 1.353 . . . . 0.0 111.883 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -118.34 151.14 38.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.46 -179.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -68.36 158.22 85.39 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.493 179.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -61.93 -32.25 84.76 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 121.268 1.312 . . . . 0.0 112.058 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 78.7 mt -58.91 -41.84 88.19 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.538 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.0 mt -65.98 -38.81 89.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.044 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -56.82 -40.51 76.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.874 -179.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -64.27 -46.11 85.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.876 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -144.99 147.32 32.51 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.719 -179.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 41.4 tpt85 -101.38 111.93 24.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.371 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.65 155.17 41.03 Favored Pre-proline 0 CA--C 1.532 0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.459 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -51.89 142.89 41.38 Favored 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 121.288 1.325 . . . . 0.0 111.854 179.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 4.3 t80 -72.22 114.31 28.32 Favored Pre-proline 0 CA--C 1.536 0.429 0 CA-C-O 118.796 -0.621 . . . . 0.0 110.132 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -57.94 129.87 35.44 Favored 'Trans proline' 0 N--CA 1.496 1.643 0 CA-C-N 120.383 1.172 . . . . 0.0 111.582 -178.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 105.06 -5.09 41.85 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-O 119.439 -0.645 . . . . 0.0 113.38 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -75.22 118.02 17.67 Favored 'General case' 0 C--O 1.23 0.078 0 CA-C-N 118.417 1.108 . . . . 0.0 110.209 174.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 8.5 ttt -93.06 118.09 67.71 Favored Pre-proline 0 CA--C 1.534 0.362 0 CA-C-O 118.662 -0.685 . . . . 0.0 110.525 -178.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.03 143.16 74.75 Favored 'Trans proline' 0 N--CA 1.497 1.692 0 C-N-CA 121.064 1.176 . . . . 0.0 111.487 173.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 42.5 t30 -97.66 108.76 21.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.712 -179.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 13.2 mt -79.76 145.92 63.38 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-O 119.04 -0.505 . . . . 0.0 109.762 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -79.19 139.93 15.25 Favored 'Trans proline' 0 N--CA 1.493 1.475 0 C-N-CA 121.178 1.252 . . . . 0.0 111.33 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 25.4 mmtp -97.16 125.69 44.87 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-O 118.85 -0.595 . . . . 0.0 109.798 178.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 9.4 Cg_exo -74.18 158.32 45.39 Favored 'Trans proline' 0 N--CA 1.497 1.732 0 C-N-CA 121.464 1.442 . . . . 0.0 112.11 172.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -53.63 157.11 10.3 Favored 'Trans proline' 0 N--CA 1.496 1.639 0 C-N-CA 121.381 1.387 . . . . 0.0 111.932 178.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 80.7 mt -49.98 -28.17 6.48 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -177.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -54.74 -37.58 66.09 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.922 0.391 . . . . 0.0 111.126 -177.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 41.9 t90 -60.85 -47.96 84.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.244 -178.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -59.93 -46.65 88.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.992 0.425 . . . . 0.0 110.307 -177.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -59.23 -45.97 89.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.661 -177.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -57.74 -44.71 86.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.573 -177.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.19 -47.56 85.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.673 -177.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -57.69 -42.91 84.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.828 -177.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 63.9 tttm -64.74 -48.15 75.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.188 -177.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -55.04 -46.53 75.31 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.244 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -64.91 -37.1 86.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.191 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -148.47 136.55 21.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.89 0.376 . . . . 0.0 110.794 -179.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 78.7 mt . . . . . 0 C--O 1.219 -0.501 0 CA-C-O 118.001 -0.999 . . . . 0.0 110.541 179.84 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.314 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.87 134.13 34.65 Favored 'Trans proline' 0 N--CA 1.495 1.601 0 CA-C-N 118.897 1.349 . . . . 0.0 112.072 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -82.13 -39.75 22.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.87 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 85.5 mtp -81.64 160.91 23.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.664 -179.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -58.89 150.75 23.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.653 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -79.45 102.16 8.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.645 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 78.5 mt -77.16 -40.09 46.68 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.836 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.0 mtp -102.54 160.32 14.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.674 -178.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.33 146.58 43.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.62 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -98.09 168.28 10.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.595 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -60.07 -36.84 78.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.066 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.4 m -57.0 -41.16 77.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.924 0.393 . . . . 0.0 110.498 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.3 mm -59.64 -44.76 94.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.088 -179.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.4 m -59.25 -45.2 91.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.986 0.422 . . . . 0.0 110.481 -177.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.0 mmt180 -58.99 -45.72 89.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.468 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.8 mtt -58.26 -43.79 88.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.121 0.486 . . . . 0.0 110.44 -178.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -59.28 -48.37 81.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.21 -178.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.4 tp -60.36 -33.39 72.36 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.146 -179.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.91 -49.77 74.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.677 0.275 . . . . 0.0 110.662 179.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.06 -41.95 89.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.974 0.416 . . . . 0.0 110.434 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 93.5 mt -54.28 -52.85 34.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.627 178.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -51.85 -27.29 12.13 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -177.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -58.94 -32.81 69.93 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -177.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.1 mm -106.17 -44.95 8.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.026 0.441 . . . . 0.0 110.064 -177.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -117.12 79.16 10.56 Favored Pre-proline 0 CA--C 1.535 0.4 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.276 -177.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -54.32 -20.22 19.29 Favored 'Trans proline' 0 N--CA 1.497 1.721 0 C-N-CA 121.473 1.449 . . . . 0.0 113.561 -175.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 14.5 p90 -93.52 15.13 16.74 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -174.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -81.28 128.12 33.46 Favored 'General case' 0 C--N 1.334 -0.1 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 173.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -97.51 -40.36 8.7 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.704 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -159.03 159.88 35.22 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.679 -0.409 . . . . 0.0 111.408 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 39.8 mt -96.22 138.39 21.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.052 178.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.9 t -90.87 -47.21 14.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.856 176.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -154.0 158.13 40.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.933 178.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 18.6 p -143.89 133.24 23.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.971 0.415 . . . . 0.0 111.153 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.3 t -110.12 127.8 55.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.74 177.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.4 m -54.86 -39.75 68.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.206 -171.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -149.81 125.91 10.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.262 0.553 . . . . 0.0 111.818 -178.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 97.2 t -145.19 142.25 22.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.447 -177.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.59 149.84 51.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.164 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -99.01 131.43 45.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.233 0.539 . . . . 0.0 111.519 -177.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -125.82 144.23 50.73 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.807 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 80.4 m -121.32 148.56 44.17 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -109.8 130.84 55.48 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.874 0.368 . . . . 0.0 110.452 176.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 36.9 t-20 -101.07 113.0 25.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.834 176.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.1 m -67.5 -32.73 73.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.976 -177.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.5 m -62.31 -38.52 89.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.666 0.269 . . . . 0.0 111.043 -177.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -94.72 -21.41 18.77 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -178.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 27.2 t30 68.74 45.76 0.99 Allowed 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.485 0.659 . . . . 0.0 109.356 -177.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -151.42 151.23 31.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.07 -176.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 81.0 m95 -87.65 141.28 28.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.341 177.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -125.02 130.47 52.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.17 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -76.47 139.93 41.03 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.9 p -92.31 177.42 6.15 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.13 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.7 p30 -86.98 12.96 10.02 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.9 t -106.62 106.44 20.62 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-O 120.988 0.423 . . . . 0.0 110.377 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -130.1 112.55 13.53 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 174.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.56 38.96 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 120.157 -1.02 . . . . 0.0 112.148 -168.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -79.77 135.42 36.49 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 175.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -98.27 129.22 44.99 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.113 -176.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -132.57 143.4 49.68 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.103 177.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 69.9 mt -101.57 128.12 54.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 172.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 13.4 m-30 -108.42 135.91 48.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.991 0.424 . . . . 0.0 111.247 -175.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 83.4 t60 -116.37 143.35 45.66 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.917 176.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -141.98 148.18 38.16 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.121 179.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -86.82 28.06 0.93 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 116.264 -0.426 . . . . 0.0 112.059 179.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.72 162.57 38.57 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 24.8 mp0 -64.06 130.7 94.67 Favored Pre-proline 0 CA--C 1.539 0.535 0 CA-C-O 118.517 -0.754 . . . . 0.0 110.031 -177.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.46 140.93 69.28 Favored 'Cis proline' 0 N--CA 1.498 1.739 0 CA-C-N 121.795 1.677 . . . . 0.0 111.63 -1.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -65.6 -42.69 91.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.04 -177.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -141.8 139.04 32.64 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.426 0.631 . . . . 0.0 110.917 -176.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.2 t -150.79 151.96 33.11 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.294 -178.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.7 mt -108.33 139.14 31.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -179.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -131.8 141.99 49.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.741 -176.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.0 mt -127.15 129.96 71.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-O 121.204 0.526 . . . . 0.0 110.048 173.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -96.17 99.52 11.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.539 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.2 t-20 -71.12 105.23 3.3 Favored 'General case' 0 C--N 1.332 -0.182 0 O-C-N 123.66 0.6 . . . . 0.0 110.8 -176.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 77.0 mtp85 -73.58 -38.62 65.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.489 -170.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 62.8 mt -75.15 -45.2 42.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.658 -174.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -95.13 -3.26 48.28 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 -175.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 11.9 m 54.89 43.11 30.48 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 121.441 0.638 . . . . 0.0 110.652 177.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.3 m -125.98 148.63 49.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.579 -177.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 76.2 p -94.74 130.27 41.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.127 -179.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -123.51 122.27 37.78 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 174.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 39.5 t -125.53 147.05 30.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.796 -176.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -146.6 126.45 6.77 Favored Pre-proline 0 CA--C 1.539 0.554 0 CA-C-O 118.683 -0.675 . . . . 0.0 110.37 174.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -75.37 150.89 37.24 Favored 'Trans proline' 0 N--CA 1.498 1.762 0 C-N-CA 121.471 1.447 . . . . 0.0 112.418 178.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 67.3 mt -93.59 138.78 19.55 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 CA-C-O 120.967 0.413 . . . . 0.0 110.263 178.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 60.2 p -132.17 157.16 44.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.688 177.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -90.91 31.81 5.43 Favored Glycine 0 CA--C 1.528 0.854 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.296 -178.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 54.5 p -111.07 -17.99 13.13 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 174.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -67.82 141.52 56.46 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-O 120.926 0.393 . . . . 0.0 110.976 -175.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.7 tt0 -111.96 135.91 51.98 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.661 175.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 68.9 mt -115.39 156.92 24.67 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.945 0.402 . . . . 0.0 110.984 -176.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -148.85 142.4 25.39 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 177.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.0 t -99.05 109.14 21.91 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.668 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -106.8 103.71 48.3 Favored Pre-proline 0 C--N 1.328 -0.34 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 172.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -70.03 140.3 41.34 Favored 'Trans proline' 0 N--CA 1.497 1.699 0 CA-C-N 120.468 1.203 . . . . 0.0 112.013 -171.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -89.8 9.92 62.85 Favored 'Cis proline' 0 N--CA 1.501 1.922 0 CA-C-N 121.317 1.506 . . . . 0.0 113.756 -4.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -88.22 170.21 11.21 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.694 0.283 . . . . 0.0 110.981 -177.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 55.9 tp -116.55 133.77 55.62 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 171.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.7 tp -125.37 139.09 53.98 Favored 'General case' 0 C--N 1.333 -0.137 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 -174.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -143.93 151.96 40.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.998 0.428 . . . . 0.0 110.65 175.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 30.3 mtm180 -104.47 144.09 32.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.668 -177.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -129.09 166.5 19.15 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.917 0.865 . . . . 0.0 111.811 -176.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -47.7 148.29 1.58 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.279 -176.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 63.41 30.85 15.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.126 -0.943 . . . . 0.0 112.256 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 67.3 m 65.67 35.25 7.08 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.848 0.356 . . . . 0.0 111.526 166.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 27.7 mmt180 -99.26 145.9 26.78 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 82.7 mt -114.93 127.47 72.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 121.088 0.47 . . . . 0.0 109.792 -178.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -136.78 150.33 48.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.506 179.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.52 169.47 25.13 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 111.41 -0.676 . . . . 0.0 111.41 -175.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -125.21 138.56 54.12 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.998 0.428 . . . . 0.0 110.625 -178.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -106.45 120.37 41.74 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.893 -1.049 . . . . 0.0 109.583 177.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -112.77 139.75 48.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.809 0.337 . . . . 0.0 110.719 -178.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -51.58 -37.51 50.18 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.63 178.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.6 t-20 -132.96 135.65 45.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.764 0.316 . . . . 0.0 110.431 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.7 t -61.36 -42.05 98.07 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.051 -177.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 -59.65 -43.23 94.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.362 0.601 . . . . 0.0 110.152 178.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -56.91 -45.01 82.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.432 0.634 . . . . 0.0 109.998 178.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 46.5 t -59.51 -39.75 84.84 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.588 178.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -59.51 -45.41 91.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.8 0.334 . . . . 0.0 110.704 -177.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 -60.11 -49.35 78.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.054 0.454 . . . . 0.0 110.663 -177.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 31.7 mm -58.42 -44.86 89.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.974 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 55.8 p -59.31 -43.97 92.61 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.708 -177.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.61 -44.03 94.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -178.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.7 mt -58.47 -48.68 79.98 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.234 0.54 . . . . 0.0 110.514 -178.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 52.7 t -58.71 -43.13 87.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.156 -178.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 26.9 m120 -58.34 -42.35 86.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.849 0.357 . . . . 0.0 110.664 -178.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.77 -41.16 99.58 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 50.3 mt -63.97 -45.01 91.02 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.794 0.33 . . . . 0.0 111.18 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 36.1 mt -63.03 -44.98 94.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.295 -176.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -70.2 -36.34 74.53 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.284 -178.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 55.6 p -69.95 159.12 34.32 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.701 0.286 . . . . 0.0 110.503 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 49.3 tttm . . . . . 0 C--O 1.22 -0.495 0 CA-C-O 118.052 -0.975 . . . . 0.0 110.598 -179.645 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.327 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -49.89 140.83 30.24 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 121.32 1.347 . . . . 0.0 111.959 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -118.53 147.58 43.52 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.443 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -81.68 152.92 70.18 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.515 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -87.78 65.4 3.72 Favored 'Trans proline' 0 N--CA 1.49 1.294 0 C-N-CA 121.684 1.59 . . . . 0.0 112.138 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 78.6 mt -57.57 -41.1 80.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.648 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 24.4 tp -124.55 131.32 53.48 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.519 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -82.13 99.95 9.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.473 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -70.79 -39.17 73.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.05 -179.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -88.98 144.17 26.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.874 0.369 . . . . 0.0 110.952 -178.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 78.7 mtp85 -87.63 149.29 24.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.158 178.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -85.87 149.18 50.17 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 119.217 -0.42 . . . . 0.0 110.326 -179.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -63.84 -179.3 0.71 Allowed 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 121.216 1.277 . . . . 0.0 111.715 177.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -60.26 149.83 74.46 Favored Pre-proline 0 C--N 1.33 -0.241 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 177.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 26.7 Cg_exo -57.86 128.79 30.38 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 120.829 1.019 . . . . 0.0 112.595 -172.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 74.91 -5.24 33.14 Favored Glycine 0 CA--C 1.533 1.173 0 CA-C-N 115.44 -0.8 . . . . 0.0 113.901 173.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -136.39 117.83 14.75 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 118.42 1.11 . . . . 0.0 111.509 -178.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 8.8 ttt -93.34 143.33 26.52 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-O 118.916 -0.564 . . . . 0.0 109.594 172.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -49.55 134.83 33.37 Favored 'Trans proline' 0 N--CA 1.497 1.727 0 C-N-CA 121.304 1.336 . . . . 0.0 111.505 172.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 49.8 t-20 -102.0 103.1 13.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.886 0.374 . . . . 0.0 111.569 -174.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 21.9 mt -94.0 151.24 39.58 Favored Pre-proline 0 C--N 1.33 -0.272 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 172.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -78.99 139.66 15.41 Favored 'Trans proline' 0 N--CA 1.491 1.364 0 C-N-CA 120.915 1.076 . . . . 0.0 111.201 175.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 5.4 mmmm -97.28 125.93 43.73 Favored Pre-proline 0 CA--C 1.536 0.432 0 CA-C-O 118.456 -0.783 . . . . 0.0 109.966 178.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -78.18 168.47 21.76 Favored 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 121.257 1.305 . . . . 0.0 111.937 175.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -65.71 154.57 73.25 Favored 'Trans proline' 0 N--CA 1.495 1.562 0 C-N-CA 121.259 1.306 . . . . 0.0 111.305 175.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.3 tp -50.01 -29.62 9.01 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -176.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 65.3 t80 -54.96 -36.83 65.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.818 0.342 . . . . 0.0 111.349 -176.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 23.6 t90 -61.53 -48.15 82.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.423 -176.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -61.89 -49.15 77.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.121 0.486 . . . . 0.0 110.366 -178.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -58.82 -44.96 90.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.871 -176.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -59.04 -46.84 87.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.623 -176.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.38 -47.19 86.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.052 0.453 . . . . 0.0 110.652 -177.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -58.87 -43.85 90.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.013 -176.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 74.6 mttt -64.85 -46.41 81.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.294 -177.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -54.96 -45.85 74.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.252 -178.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -65.0 -36.97 86.11 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.062 179.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -70.67 141.02 51.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.77 0.319 . . . . 0.0 110.447 179.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 83.4 mt . . . . . 0 C--O 1.22 -0.46 0 CA-C-O 117.962 -1.018 . . . . 0.0 110.53 -179.778 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.3 0 N-CA-C 109.591 -1.404 . . . . 0.0 109.591 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -51.47 130.57 33.58 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 CA-C-N 118.901 1.351 . . . . 0.0 112.042 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -59.49 -41.22 89.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.713 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 86.4 mtp -57.45 -39.4 76.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.905 -179.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -77.75 123.42 26.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.845 0.355 . . . . 0.0 110.617 -179.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -75.59 152.11 37.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.529 179.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 29.7 tp -56.9 -40.67 76.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.674 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.1 mmm -137.41 129.06 28.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.326 179.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -178.61 134.11 0.14 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.513 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -91.17 113.45 25.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.539 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -62.88 -35.27 79.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.331 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.1 t -56.6 -40.69 75.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.904 0.383 . . . . 0.0 110.662 -178.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.6 mm -59.93 -45.31 95.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.199 -178.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.9 m -59.14 -44.62 92.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.467 -178.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -59.43 -46.15 89.54 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.593 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 88.4 mtp -58.17 -43.72 87.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.053 0.454 . . . . 0.0 110.423 -178.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -59.99 -48.65 80.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.268 -178.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.8 tp -60.72 -32.89 72.13 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.729 -0.388 . . . . 0.0 111.175 -179.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.22 -49.86 74.08 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.726 0.298 . . . . 0.0 110.632 179.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.8 -42.13 88.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.057 0.456 . . . . 0.0 110.456 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 97.7 mt -54.28 -52.88 34.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.627 178.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -53.26 -23.7 9.58 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -57.93 -34.65 70.11 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 120.611 0.244 . . . . 0.0 111.575 -178.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 48.0 mm -107.77 -42.83 6.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.973 0.416 . . . . 0.0 110.208 -177.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -117.16 77.43 9.39 Favored Pre-proline 0 CA--C 1.535 0.372 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.808 -179.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -55.72 -21.19 31.13 Favored 'Trans proline' 0 N--CA 1.498 1.752 0 C-N-CA 121.524 1.482 . . . . 0.0 113.447 -174.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.7 p90 -87.47 -2.15 58.42 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -174.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.33 127.21 31.34 Favored 'General case' 0 N--CA 1.461 0.095 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 177.133 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -97.54 -40.35 8.69 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.653 -175.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -154.79 157.44 37.95 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.3 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 35.4 mt -93.87 136.75 24.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.824 177.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.5 t -87.41 -44.98 16.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.68 177.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -158.35 157.94 33.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.845 178.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.2 p -142.87 132.9 24.32 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.999 0.428 . . . . 0.0 111.266 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.6 t -109.98 125.74 53.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.663 176.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.1 m -54.84 -38.93 68.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.169 -172.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -148.89 126.45 11.67 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.247 0.546 . . . . 0.0 111.76 -178.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 97.3 t -145.2 140.19 22.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.333 -178.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.91 149.84 51.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.722 0.296 . . . . 0.0 111.268 -177.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -100.77 130.33 46.78 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.549 -176.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -126.23 143.96 50.95 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.73 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 96.2 m -123.51 146.73 47.86 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -108.64 132.0 54.33 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.962 0.41 . . . . 0.0 110.333 176.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -105.18 114.22 28.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.82 176.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 84.8 p -70.8 -29.69 65.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.0 -0.546 . . . . 0.0 112.338 -175.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.3 t -58.9 -39.23 80.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.805 0.336 . . . . 0.0 110.943 -177.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -100.58 -17.88 16.86 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.9 t30 69.82 48.05 0.59 Allowed 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.596 0.712 . . . . 0.0 109.46 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -153.57 151.62 29.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.774 -178.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -88.37 142.78 27.45 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.393 178.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -124.99 130.39 52.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.86 176.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.5 pttp -75.02 141.26 43.94 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 177.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 67.5 p -92.3 175.55 6.8 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.699 -0.401 . . . . 0.0 110.067 -179.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -85.31 13.28 6.72 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.7 t -107.95 106.36 20.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-O 121.014 0.435 . . . . 0.0 110.351 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -132.1 112.2 12.12 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 174.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.64 176.53 38.95 Favored Glycine 0 CA--C 1.52 0.389 0 C-N-CA 120.184 -1.007 . . . . 0.0 112.222 -168.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.97 135.37 36.91 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 175.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -98.94 127.75 44.94 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.107 -176.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -131.75 141.97 49.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.331 177.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 63.9 mt -101.59 129.24 53.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 173.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 10.3 m-30 -108.49 137.38 46.54 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.791 0.329 . . . . 0.0 111.213 -175.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 57.6 t60 -121.35 143.3 49.27 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.289 176.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 29.1 ttp180 -142.01 153.84 44.56 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.303 177.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -86.85 28.17 0.92 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.152 -179.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -155.78 152.87 29.0 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -63.95 133.55 95.62 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-O 118.5 -0.762 . . . . 0.0 110.243 -176.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -68.19 140.92 57.98 Favored 'Cis proline' 0 N--CA 1.499 1.794 0 CA-C-N 121.703 1.644 . . . . 0.0 111.45 -0.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -66.74 -41.32 88.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.135 -176.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -142.44 143.42 32.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.7 0.762 . . . . 0.0 111.249 -175.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.6 t -150.31 151.95 33.72 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.847 -179.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 48.2 mt -112.35 138.4 41.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 -177.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -131.79 142.09 49.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.03 -177.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.8 mt -123.06 131.87 72.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.252 0.549 . . . . 0.0 109.783 172.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -97.8 99.58 10.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.426 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -72.03 107.28 4.66 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 123.618 0.573 . . . . 0.0 110.992 -175.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -73.4 -41.96 62.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.278 -171.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 74.7 mt -70.3 -45.13 66.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.671 -175.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 39.9 m-20 -95.09 -3.23 48.48 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -175.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.8 p 51.07 42.31 28.43 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.523 0.678 . . . . 0.0 111.065 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 38.5 m -125.2 149.08 48.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.164 -179.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.4 p -98.2 137.73 36.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.999 -178.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -132.97 122.19 23.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.118 175.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 p -125.62 150.38 30.89 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.049 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -148.71 132.8 8.68 Favored Pre-proline 0 CA--C 1.538 0.503 0 CA-C-O 118.879 -0.581 . . . . 0.0 110.401 174.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -75.46 150.95 36.93 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 121.578 1.518 . . . . 0.0 112.29 179.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 69.7 mt -90.51 136.31 24.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.2 177.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.6 p -132.14 158.49 41.53 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.839 177.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -95.7 35.46 4.3 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.058 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.3 p -109.0 -23.33 11.74 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 173.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.89 147.68 51.34 Favored 'General case' 0 C--O 1.231 0.082 0 CA-C-O 120.887 0.375 . . . . 0.0 111.207 -176.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 59.3 tt0 -118.56 135.91 54.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.799 175.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 51.6 mt -114.25 161.05 18.34 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.715 -176.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -150.06 142.68 24.53 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 177.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.0 t -98.5 109.15 21.95 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.444 -0.502 . . . . 0.0 110.588 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 -106.9 103.75 48.74 Favored Pre-proline 0 C--N 1.328 -0.344 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 171.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -70.26 143.15 47.59 Favored 'Trans proline' 0 N--CA 1.497 1.734 0 CA-C-N 120.496 1.213 . . . . 0.0 112.003 -171.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -91.17 14.73 49.52 Favored 'Cis proline' 0 N--CA 1.499 1.798 0 CA-C-N 120.964 1.38 . . . . 0.0 113.561 -3.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -97.0 172.64 7.73 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.458 0.171 . . . . 0.0 110.58 -177.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 52.5 tp -114.5 135.07 54.52 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 173.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.4 tp -127.17 139.56 52.87 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 -174.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 19.6 p90 -146.61 160.9 41.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.91 0.386 . . . . 0.0 110.614 175.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 30.5 mtm105 -101.9 146.15 28.24 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.471 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 36.3 t30 -127.26 164.64 21.27 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.78 0.8 . . . . 0.0 111.732 -176.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -48.0 147.51 2.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.203 -176.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 63.23 30.95 15.78 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.152 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 46.5 t 66.62 35.2 5.45 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.896 0.379 . . . . 0.0 111.583 166.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -100.74 152.63 20.25 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 73.9 mt -110.19 129.18 65.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 -179.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -138.3 150.25 46.45 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.789 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -144.29 169.34 26.38 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 111.359 -0.696 . . . . 0.0 111.359 -176.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -125.34 140.96 52.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.948 0.404 . . . . 0.0 110.809 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 17.2 t90 -108.38 127.74 54.15 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.81 175.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -115.26 142.02 47.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.762 0.315 . . . . 0.0 110.356 178.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -50.93 -38.25 49.05 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.78 178.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -133.39 137.27 45.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.309 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.0 m -59.81 -41.74 91.92 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.957 -177.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -58.17 -42.24 85.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.285 0.564 . . . . 0.0 110.18 178.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -57.26 -44.78 84.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.508 0.67 . . . . 0.0 109.909 178.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 43.5 t -59.22 -37.01 76.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.797 176.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -63.11 -51.73 65.39 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 121.208 -0.197 . . . . 0.0 111.182 -174.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 29.6 ptt180 -64.76 -42.41 95.14 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.35 -0.54 . . . . 0.0 111.339 -175.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 26.5 mm -60.04 -48.13 89.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.175 0 C-N-CA 120.507 -0.477 . . . . 0.0 109.883 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 66.5 p -59.32 -43.2 92.71 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.832 0.349 . . . . 0.0 110.644 -177.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.77 -43.73 94.47 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.631 -0.987 . . . . 0.0 110.631 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.1 mt -57.93 -47.78 81.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.214 0.531 . . . . 0.0 110.497 -178.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 49.3 t -59.01 -44.14 90.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.035 -179.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -57.36 -42.74 82.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.689 -178.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.12 -46.02 95.37 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.006 -0.838 . . . . 0.0 111.006 -178.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 56.9 mt -57.83 -43.07 85.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.016 0.436 . . . . 0.0 110.507 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 39.3 mt -60.25 -40.2 89.46 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.802 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 31.9 pttt -94.63 11.15 32.13 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 64.7 m -117.22 147.11 42.79 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.875 0.369 . . . . 0.0 110.401 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt . . . . . 0 C--O 1.22 -0.483 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.494 -179.958 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.294 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -49.86 148.72 12.16 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 121.342 1.361 . . . . 0.0 111.955 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -95.16 125.64 39.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.512 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -65.92 154.24 89.72 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.568 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -87.29 33.04 0.42 Allowed 'Trans proline' 0 N--CA 1.49 1.316 0 C-N-CA 121.682 1.588 . . . . 0.0 112.37 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 29.8 tp -56.75 -39.97 74.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.791 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.0 mt -84.26 142.65 30.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.394 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -90.1 116.15 27.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.608 -179.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -62.54 -40.61 97.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.725 179.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -144.01 167.11 23.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.695 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 37.3 ptt-85 -98.44 142.83 29.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.7 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -65.24 156.42 81.39 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.688 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -68.29 146.44 69.31 Favored 'Trans proline' 0 N--CA 1.495 1.61 0 C-N-CA 121.244 1.296 . . . . 0.0 112.012 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -125.95 99.97 31.15 Favored Pre-proline 0 CA--C 1.533 0.306 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.998 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -57.9 128.96 31.01 Favored 'Trans proline' 0 N--CA 1.497 1.69 0 C-N-CA 121.103 1.202 . . . . 0.0 111.506 -178.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 102.02 -5.13 52.94 Favored Glycine 0 CA--C 1.537 1.414 0 CA-C-N 115.779 -0.646 . . . . 0.0 113.222 -178.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -84.29 145.69 28.15 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 118.165 0.982 . . . . 0.0 110.48 177.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 28.9 ttp -66.39 143.45 98.25 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 119.067 -0.492 . . . . 0.0 110.045 -179.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -58.05 156.91 27.0 Favored 'Trans proline' 0 N--CA 1.496 1.656 0 C-N-CA 121.242 1.294 . . . . 0.0 111.825 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 10.9 p-10 -103.99 111.02 23.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.902 -179.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 8.3 mt -79.76 130.23 68.14 Favored Pre-proline 0 CA--C 1.533 0.307 0 CA-C-O 118.169 -0.92 . . . . 0.0 109.412 177.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -79.14 139.55 15.08 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 CA-C-N 120.615 1.255 . . . . 0.0 111.155 174.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 41.6 mtmt -97.38 126.02 43.21 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-O 118.453 -0.784 . . . . 0.0 110.32 179.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -64.55 167.8 14.38 Favored 'Trans proline' 0 N--CA 1.498 1.757 0 CA-C-N 120.564 1.237 . . . . 0.0 111.619 175.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -56.55 157.11 19.74 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 121.402 1.401 . . . . 0.0 111.445 178.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 12.3 tp -50.01 -29.96 9.68 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -176.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 58.2 t80 -54.95 -37.42 66.43 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.921 0.391 . . . . 0.0 111.161 -177.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 43.6 t90 -60.2 -48.05 83.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.225 -177.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -61.88 -47.94 82.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.026 0.441 . . . . 0.0 110.626 -177.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -59.63 -45.09 93.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.86 -177.099 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 42.7 tp10 -59.23 -46.17 89.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.695 -176.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.26 -48.34 82.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.039 0.447 . . . . 0.0 110.751 -177.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -59.29 -43.02 92.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.15 -176.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 83.5 tttt -64.22 -47.14 80.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.143 -177.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 57.2 tp60 -54.99 -47.97 73.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.15 -178.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 42.2 tp10 -64.93 -37.06 86.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.149 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -129.96 112.44 13.51 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.882 0.372 . . . . 0.0 110.622 -179.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 78.4 mt . . . . . 0 C--O 1.221 -0.426 0 CA-C-O 117.962 -1.018 . . . . 0.0 110.607 -179.955 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.257 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -67.57 132.63 27.61 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 121.307 1.338 . . . . 0.0 111.965 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -58.67 -40.78 84.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.746 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 65.0 mtt -91.42 141.85 28.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.656 -179.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -68.12 148.33 51.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.634 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -138.17 173.66 11.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.484 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 30.0 tp -57.09 -41.53 79.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.565 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt -104.66 133.97 48.62 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.311 179.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -150.55 168.11 25.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.693 -179.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -57.48 161.76 3.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.74 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -59.98 -32.82 71.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.48 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.4 m -56.11 -40.46 73.74 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.908 0.385 . . . . 0.0 110.639 -178.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.7 mm -59.56 -44.82 94.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.128 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.5 m -58.62 -45.07 90.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.061 0.458 . . . . 0.0 110.439 -178.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -59.26 -45.38 91.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.58 -178.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 89.2 mtp -58.27 -42.4 86.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.449 -178.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -60.1 -49.93 75.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.287 -178.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 12.7 tp -60.53 -31.02 70.12 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.323 -179.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.76 -50.92 67.17 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.676 0.274 . . . . 0.0 110.733 178.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.36 -40.23 81.7 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.953 0.406 . . . . 0.0 110.674 179.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 97.7 mt -54.24 -52.9 33.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.485 177.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -51.55 -22.38 3.2 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.9 mmtt -58.72 -35.09 72.12 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 122.296 -0.253 . . . . 0.0 111.631 -178.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 48.2 mm -108.19 -43.26 6.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.908 0.385 . . . . 0.0 110.116 -177.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -117.36 77.3 9.98 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.129 -176.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -54.84 -22.45 29.86 Favored 'Trans proline' 0 N--CA 1.498 1.747 0 C-N-CA 121.5 1.466 . . . . 0.0 113.33 -176.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.0 p90 -88.65 8.74 27.02 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -175.011 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -88.61 123.81 33.44 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 174.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -104.86 -40.06 6.07 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.991 -173.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -132.02 145.63 51.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.145 -176.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 63.0 mt -96.66 128.13 48.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.87 -0.604 . . . . 0.0 109.731 173.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.3 t -89.26 -47.11 15.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.047 0.451 . . . . 0.0 109.965 -179.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -154.22 150.26 27.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.023 177.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.8 p -138.46 131.95 30.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.059 0.456 . . . . 0.0 110.743 179.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.4 t -104.74 126.9 52.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.482 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.2 m -53.91 -38.03 64.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.366 -171.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -151.92 127.82 10.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.225 0.536 . . . . 0.0 111.724 -178.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 94.9 t -145.15 136.99 20.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.542 -177.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -126.36 149.86 48.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.173 -178.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -96.99 133.09 42.12 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.334 0.588 . . . . 0.0 111.788 -176.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -127.04 137.98 53.15 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.283 177.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.4 m -119.03 143.46 47.08 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 178.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -107.93 130.57 55.02 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.008 0.432 . . . . 0.0 110.246 177.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -101.76 113.74 27.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.063 176.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 86.1 p -70.88 -25.79 62.95 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -177.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.0 m -58.89 -36.4 74.61 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 121.121 -0.232 . . . . 0.0 111.244 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -113.95 -12.04 12.7 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -177.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 58.7 t30 69.74 50.51 0.49 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-O 121.704 0.764 . . . . 0.0 109.592 179.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.7 tp10 -148.01 146.93 29.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.908 -178.315 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 83.7 m95 -89.2 141.0 28.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.176 176.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -121.42 126.31 49.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.229 -0.441 . . . . 0.0 109.916 176.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -73.17 135.14 44.6 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 177.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 67.9 p -92.35 162.1 14.4 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.24 -177.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -75.95 5.68 6.21 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.3 t -97.16 106.42 18.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 121.091 0.472 . . . . 0.0 110.29 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -131.73 115.5 16.09 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 176.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.5 38.96 Favored Glycine 0 CA--C 1.52 0.392 0 C-N-CA 120.063 -1.065 . . . . 0.0 112.392 -169.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -80.94 136.47 36.04 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -102.18 123.8 46.65 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -175.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -128.53 140.92 51.55 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.644 0.259 . . . . 0.0 110.721 177.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 74.8 mt -101.63 127.35 55.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 170.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 11.2 m-30 -108.53 140.62 41.61 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.018 0.437 . . . . 0.0 111.665 -177.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -108.82 143.38 38.08 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.934 173.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -140.89 145.51 36.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.028 178.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -86.93 28.17 0.93 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.217 -0.447 . . . . 0.0 112.03 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.28 164.15 36.7 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -63.96 128.83 93.44 Favored Pre-proline 0 CA--C 1.539 0.557 0 CA-C-O 118.401 -0.809 . . . . 0.0 110.024 -177.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.61 140.9 69.9 Favored 'Cis proline' 0 N--CA 1.497 1.719 0 CA-C-N 121.909 1.717 . . . . 0.0 111.738 -1.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -63.97 -41.37 97.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.986 -177.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -143.15 137.94 29.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.315 0.579 . . . . 0.0 110.911 -177.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.0 t -150.04 151.63 33.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.421 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 56.7 mt -115.08 139.81 39.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.961 -177.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -131.79 142.09 49.65 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.082 -178.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.1 mt -119.84 126.69 75.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.207 0.527 . . . . 0.0 109.771 171.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -94.66 99.56 11.65 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.648 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -73.28 105.96 4.91 Favored 'General case' 0 C--N 1.332 -0.16 0 O-C-N 123.687 0.617 . . . . 0.0 110.934 -175.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 25.9 mmt85 -74.36 -40.48 62.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.447 -170.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 45.0 mt -74.07 -45.16 51.05 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.77 0.319 . . . . 0.0 111.411 -175.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 29.8 t-20 -95.04 -3.2 48.7 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -175.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.5 p 50.95 43.22 28.83 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.496 0.665 . . . . 0.0 111.147 178.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 37.2 m -122.97 142.94 50.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.143 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.2 p -91.83 127.97 37.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.29 -178.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -117.46 122.15 42.96 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 175.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 p -125.56 146.96 30.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-O 120.705 0.288 . . . . 0.0 111.08 -178.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -149.83 126.48 5.3 Favored Pre-proline 0 CA--C 1.539 0.546 0 CA-C-O 118.557 -0.735 . . . . 0.0 110.345 175.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -75.36 150.86 37.22 Favored 'Trans proline' 0 N--CA 1.498 1.765 0 C-N-CA 121.388 1.392 . . . . 0.0 112.105 177.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 63.1 mt -90.67 135.95 25.28 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 CA-C-O 120.937 0.399 . . . . 0.0 110.376 179.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.9 p -132.12 154.71 49.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.667 177.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -93.79 35.82 4.0 Favored Glycine 0 CA--C 1.525 0.68 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.048 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 46.7 p -111.0 -21.08 12.18 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 111.995 0.368 . . . . 0.0 111.995 174.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.6 mt -68.43 147.19 52.42 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-O 120.909 0.385 . . . . 0.0 111.367 -175.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.9 tt0 -114.31 135.82 53.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.768 176.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 60.4 mt -115.6 157.58 23.93 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.959 0.409 . . . . 0.0 110.882 -176.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -149.22 142.39 25.01 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 178.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.1 t -99.03 109.14 21.93 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.613 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -106.8 103.73 48.36 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 172.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -70.55 142.99 45.8 Favored 'Trans proline' 0 N--CA 1.497 1.72 0 CA-C-N 120.546 1.231 . . . . 0.0 112.138 -170.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -90.62 14.27 50.96 Favored 'Cis proline' 0 N--CA 1.5 1.901 0 CA-C-N 121.049 1.41 . . . . 0.0 113.534 -4.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -94.89 170.42 9.44 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 122.378 0.271 . . . . 0.0 110.758 -177.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 54.1 tp -116.1 133.2 56.28 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 173.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.8 tp -124.67 139.98 53.36 Favored 'General case' 0 C--N 1.334 -0.101 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 -173.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -144.5 153.09 41.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.972 0.415 . . . . 0.0 110.564 175.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.6 mtm180 -103.89 144.35 31.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.739 -177.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -127.57 163.05 25.02 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.893 0.854 . . . . 0.0 111.761 -176.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -47.84 149.24 1.35 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.14 -177.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 87.5 mtt-85 63.5 30.87 15.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.155 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 34.9 m 66.27 35.16 6.07 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.913 0.387 . . . . 0.0 111.628 165.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 40.3 mtp180 -99.87 147.32 25.65 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 82.9 mt -113.33 126.92 70.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -178.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -136.12 148.36 48.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.429 -178.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -144.73 169.3 26.62 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 120.771 -0.728 . . . . 0.0 111.651 -178.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -126.0 141.85 51.78 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.292 -0.454 . . . . 0.0 110.565 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 77.5 t90 -106.63 124.02 48.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.511 174.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -109.65 140.19 43.78 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 123.312 0.383 . . . . 0.0 110.523 -179.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -50.33 -37.13 35.15 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.845 178.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 39.1 t-20 -133.72 135.49 44.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.345 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.2 m -61.63 -42.77 99.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.056 -177.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -59.43 -43.64 93.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.373 0.606 . . . . 0.0 110.084 179.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -56.56 -43.7 80.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.133 178.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 51.4 t -59.31 -40.99 87.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.353 177.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -58.88 -44.57 91.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.8 0.333 . . . . 0.0 110.627 -177.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -59.99 -49.74 76.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.944 0.402 . . . . 0.0 110.649 -177.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 29.8 mm -58.46 -45.31 90.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.099 0.476 . . . . 0.0 110.067 -178.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 61.1 p -59.41 -43.03 93.1 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.73 -177.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.73 -43.99 94.3 Favored Glycine 0 CA--C 1.523 0.545 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 -178.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.8 mt -58.4 -48.21 81.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.074 0.464 . . . . 0.0 110.459 -178.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 55.4 t -59.0 -42.57 86.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.167 -179.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 26.6 m120 -57.38 -42.07 81.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.896 0.379 . . . . 0.0 110.605 -179.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -59.65 -44.63 96.72 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 58.0 mt -57.68 -42.99 84.74 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.98 0.419 . . . . 0.0 110.429 179.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 17.7 mt -58.18 -41.88 84.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.548 179.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 38.0 pttt -96.47 11.14 36.07 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 29.7 t -114.4 144.45 43.28 Favored 'General case' 0 N--CA 1.462 0.14 0 O-C-N 122.141 -0.349 . . . . 0.0 110.453 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.1 mttt . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 118.043 -0.979 . . . . 0.0 110.566 179.982 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.343 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -65.16 142.69 74.96 Favored 'Trans proline' 0 N--CA 1.497 1.687 0 CA-C-N 119.296 1.548 . . . . 0.0 111.936 -176.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -120.35 155.4 33.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.492 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -62.41 154.1 73.58 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.572 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.25 132.41 19.37 Favored 'Trans proline' 0 N--CA 1.495 1.589 0 C-N-CA 121.298 1.332 . . . . 0.0 112.117 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 78.6 mt -63.79 -38.65 91.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.937 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 27.2 tp -78.6 139.0 38.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.86 0.362 . . . . 0.0 110.605 -179.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 51.7 tp60 -87.33 129.79 34.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.502 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -57.71 -38.67 75.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.048 -179.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -56.56 145.51 28.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.876 0.37 . . . . 0.0 110.75 -179.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 34.4 ttm180 -72.38 144.66 48.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.705 -179.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -57.3 164.29 2.74 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.453 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -48.14 142.01 16.87 Favored 'Trans proline' 0 N--CA 1.495 1.58 0 C-N-CA 121.425 1.417 . . . . 0.0 112.259 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 29.7 p90 -138.99 163.86 43.37 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.51 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -57.85 129.02 31.31 Favored 'Trans proline' 0 N--CA 1.495 1.596 0 C-N-CA 121.19 1.26 . . . . 0.0 111.664 -178.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 100.74 -5.14 56.59 Favored Glycine 0 CA--C 1.535 1.318 0 CA-C-N 115.948 -0.569 . . . . 0.0 113.424 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -64.61 140.34 58.86 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 118.206 1.003 . . . . 0.0 110.42 177.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 6.8 ttt -61.29 139.24 94.68 Favored Pre-proline 0 CA--C 1.534 0.364 0 CA-C-O 118.898 -0.572 . . . . 0.0 109.782 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.11 148.9 40.34 Favored 'Trans proline' 0 N--CA 1.495 1.581 0 C-N-CA 121.243 1.296 . . . . 0.0 111.926 178.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 52.9 t-20 -94.88 104.82 16.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.626 -179.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 18.9 mt -70.81 134.67 85.84 Favored Pre-proline 0 C--O 1.234 0.279 0 CA-C-O 118.461 -0.781 . . . . 0.0 109.488 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.21 139.65 15.04 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 CA-C-N 120.435 1.191 . . . . 0.0 111.083 174.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 19.8 mtmm -97.31 125.94 43.64 Favored Pre-proline 0 CA--C 1.535 0.401 0 CA-C-O 118.514 -0.755 . . . . 0.0 110.188 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -63.25 161.15 31.69 Favored 'Trans proline' 0 N--CA 1.498 1.759 0 CA-C-N 120.563 1.237 . . . . 0.0 111.553 176.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -49.19 157.04 2.07 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 121.38 1.386 . . . . 0.0 111.812 178.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 6.2 mp -49.99 -25.58 3.47 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -176.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 68.8 t80 -55.95 -38.46 70.39 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.809 0.337 . . . . 0.0 111.084 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 50.5 t90 -60.88 -48.08 83.42 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.509 -176.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -63.61 -49.27 73.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.067 0.46 . . . . 0.0 110.785 -177.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -59.34 -43.86 92.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.926 -176.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -59.19 -48.32 82.04 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.638 -176.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.17 -49.12 78.87 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.733 -177.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -59.6 -41.48 90.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.226 -176.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 26.4 tptp -64.81 -48.33 74.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.126 -177.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -55.03 -47.42 74.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.227 -178.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -64.95 -36.83 85.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.215 178.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -63.35 148.15 49.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.801 0.334 . . . . 0.0 110.608 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 6.5 tt . . . . . 0 C--O 1.22 -0.495 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.586 179.929 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.302 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -67.88 139.53 47.81 Favored 'Trans proline' 0 N--CA 1.496 1.636 0 CA-C-N 118.906 1.353 . . . . 0.0 111.96 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -57.31 -41.63 80.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.613 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 72.1 mtm -104.82 157.83 16.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.565 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -141.19 152.75 44.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.581 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -67.9 151.23 47.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.552 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 79.0 mt -56.78 -40.53 76.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.696 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.5 mtp -101.31 139.75 36.55 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.444 179.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -140.55 155.77 46.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.505 -179.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.3 p30 -78.0 -177.98 5.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.66 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -63.38 -31.44 72.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.854 -179.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.1 m -57.36 -44.58 84.5 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.911 0.386 . . . . 0.0 110.589 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 48.2 mm -59.81 -44.7 94.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.216 -178.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.0 m -59.58 -44.05 93.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.571 -177.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -59.92 -45.2 93.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.563 -178.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 87.8 mtp -58.26 -44.21 88.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.093 0.473 . . . . 0.0 110.458 -178.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -60.75 -49.18 78.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.296 -178.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.4 tp -59.75 -33.02 71.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.058 -178.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.34 -50.58 69.44 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.649 0.262 . . . . 0.0 110.851 179.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.96 -41.67 83.38 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.944 0.402 . . . . 0.0 110.404 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 93.9 mt -54.13 -52.98 32.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.724 178.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -51.93 -24.76 6.85 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -178.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 65.8 mmtt -59.24 -33.73 71.37 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -177.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.6 mm -109.77 -43.67 5.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.0 0.429 . . . . 0.0 110.071 -176.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -117.61 77.15 10.7 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.968 -178.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -55.2 -20.49 24.78 Favored 'Trans proline' 0 N--CA 1.497 1.731 0 C-N-CA 121.47 1.447 . . . . 0.0 113.531 -175.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.3 p90 -90.61 11.62 21.44 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -174.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -88.15 131.21 34.8 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 174.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -108.31 -38.69 5.66 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.745 0.307 . . . . 0.0 111.145 -175.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -135.86 147.65 48.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.007 0.432 . . . . 0.0 111.183 -175.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 21.8 mt -99.39 134.28 39.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 171.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.6 t -92.83 -47.13 13.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.242 -0.435 . . . . 0.0 109.877 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -152.23 155.06 36.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.014 178.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.1 p -142.7 131.95 23.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.171 0.51 . . . . 0.0 110.895 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.6 t -107.27 126.58 52.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.695 177.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.7 t -54.38 -38.67 66.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.154 -172.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 -150.7 127.21 10.78 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.294 0.569 . . . . 0.0 111.689 -179.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 92.8 t -144.84 138.55 22.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.336 -178.094 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.59 149.81 50.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.303 -177.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -99.68 131.2 45.82 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.259 0.552 . . . . 0.0 111.833 -176.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -123.85 141.75 51.75 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.466 178.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 72.5 m -120.99 147.01 46.08 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -107.79 131.9 53.97 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.951 0.405 . . . . 0.0 110.416 175.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.6 t-20 -104.31 115.65 30.76 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.977 178.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 27.1 t -67.65 -33.12 74.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.9 -177.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.1 m -60.56 -39.79 89.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.752 0.31 . . . . 0.0 110.887 -177.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -93.13 -21.52 19.63 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 19.2 t30 69.13 42.69 1.2 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-O 121.288 0.566 . . . . 0.0 109.809 -177.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.0 mt-10 -151.34 164.17 37.29 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.156 -177.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 83.9 m95 -94.12 141.66 28.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.352 177.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.9 tp10 -124.97 127.53 47.17 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 177.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.7 ttpp -73.64 139.15 45.25 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 177.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 52.4 p -92.23 172.23 8.55 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.071 -178.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -84.08 12.6 6.13 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 178.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.7 t -104.05 106.43 20.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-O 121.068 0.461 . . . . 0.0 110.346 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -132.22 114.43 14.45 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 176.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.59 176.51 38.91 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.022 -1.085 . . . . 0.0 112.3 -169.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -81.31 135.81 35.73 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 175.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -99.42 127.34 45.46 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.883 -0.327 . . . . 0.0 110.126 -176.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -131.67 142.46 49.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.723 0.297 . . . . 0.0 110.339 177.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 68.6 mt -101.61 127.95 54.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 171.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 16.3 m-30 -108.53 135.55 49.61 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.855 0.36 . . . . 0.0 111.302 -175.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 68.8 t60 -109.71 143.28 39.72 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.104 174.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 60.5 ttt180 -141.92 146.75 36.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.233 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -86.88 28.11 0.93 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.112 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.7 166.16 33.53 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -63.99 127.64 92.03 Favored Pre-proline 0 CA--C 1.539 0.537 0 CA-C-O 118.445 -0.788 . . . . 0.0 110.066 -177.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -75.98 140.94 68.94 Favored 'Cis proline' 0 N--CA 1.497 1.702 0 CA-C-N 121.89 1.711 . . . . 0.0 111.765 -1.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -62.45 -42.26 99.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.945 -178.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -142.84 138.58 30.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.436 0.636 . . . . 0.0 110.891 -177.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.8 t -150.19 151.73 33.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.311 -178.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 47.7 mt -110.31 139.81 32.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -131.78 142.03 49.64 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.761 -176.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 59.7 mt -124.62 128.99 73.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.249 0.547 . . . . 0.0 110.06 173.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -96.26 99.54 11.24 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.53 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.2 t-20 -74.7 106.29 6.19 Favored 'General case' 0 C--N 1.331 -0.209 0 O-C-N 123.647 0.592 . . . . 0.0 110.933 -175.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 71.2 mtm180 -73.16 -43.91 60.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.588 -170.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 29.8 mt -72.56 -45.09 60.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.634 -174.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 37.2 t-20 -95.13 -3.11 48.57 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -174.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 73.0 p 50.73 42.9 28.0 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.478 0.656 . . . . 0.0 111.186 177.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.0 m -125.43 133.87 52.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.275 -179.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 80.4 p -80.16 130.45 35.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.301 -178.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -118.46 122.22 42.19 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 174.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 34.6 t -125.48 145.62 32.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-O 120.725 0.298 . . . . 0.0 110.674 -177.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -148.26 126.41 5.93 Favored Pre-proline 0 CA--C 1.538 0.492 0 CA-C-O 118.64 -0.695 . . . . 0.0 110.496 174.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -75.42 150.9 37.02 Favored 'Trans proline' 0 N--CA 1.5 1.875 0 C-N-CA 121.462 1.442 . . . . 0.0 112.184 177.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 66.5 mt -92.15 133.09 34.69 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.31 178.257 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.6 p -132.21 159.54 38.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.732 177.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -94.54 36.69 3.67 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.96 -178.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 51.7 p -111.07 -22.49 11.44 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 174.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.84 145.04 54.07 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-O 120.878 0.37 . . . . 0.0 111.251 -176.062 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 57.5 tt0 -116.93 135.78 53.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.729 175.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 63.2 mt -113.28 159.19 19.62 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.702 -176.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -150.02 143.94 25.49 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 178.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 29.3 t -99.59 109.15 21.68 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.462 -0.495 . . . . 0.0 110.326 178.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 19.3 mm-40 -106.83 103.75 48.55 Favored Pre-proline 0 C--N 1.329 -0.317 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 172.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -67.38 142.37 59.68 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 CA-C-N 120.491 1.211 . . . . 0.0 111.787 -172.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -90.76 12.73 55.38 Favored 'Cis proline' 0 N--CA 1.5 1.899 0 CA-C-N 121.146 1.445 . . . . 0.0 113.493 -4.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -94.9 170.17 9.62 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 122.304 0.242 . . . . 0.0 110.618 -176.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 58.0 tp -111.99 134.91 53.25 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 171.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.6 tp -126.88 139.65 52.92 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.5 0.191 . . . . 0.0 110.606 -173.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 50.9 p90 -145.5 156.81 43.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.798 0.332 . . . . 0.0 110.534 175.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.8 mtm105 -102.07 146.89 27.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.66 -178.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -126.47 163.81 22.52 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.591 0.71 . . . . 0.0 111.374 -177.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -47.16 144.86 2.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.192 -177.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 31.9 ttt85 65.27 30.92 11.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.416 -0.811 . . . . 0.0 112.021 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.5 p 65.59 35.24 7.22 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.871 0.367 . . . . 0.0 111.719 166.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 91.7 mtt-85 -98.0 152.74 18.95 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 78.3 mt -114.58 127.58 72.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -177.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -137.56 150.32 47.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.675 178.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.06 169.3 25.03 Favored Glycine 0 CA--C 1.522 0.53 0 N-CA-C 111.346 -0.702 . . . . 0.0 111.346 -176.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -125.3 139.78 53.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.902 0.382 . . . . 0.0 110.894 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 66.5 t90 -107.1 121.57 44.75 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.574 174.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -111.74 140.19 46.58 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.131 0.269 . . . . 0.0 110.461 179.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -49.93 -37.72 33.03 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.793 178.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 46.3 t-20 -134.76 131.43 37.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.107 178.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.4 p -57.14 -38.24 73.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.884 -179.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -57.81 -44.84 86.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.524 0.678 . . . . 0.0 109.962 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -57.28 -45.28 84.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.026 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 47.5 t -59.3 -39.59 83.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.612 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -60.07 -46.26 90.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.908 0.385 . . . . 0.0 110.705 -177.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -59.96 -48.96 79.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.652 -177.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 31.7 mm -58.62 -44.74 90.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.037 -178.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 57.6 p -59.46 -43.82 93.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.739 -177.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.78 -44.74 94.08 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.687 -0.965 . . . . 0.0 110.687 -178.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.1 mt -58.32 -47.64 83.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.115 0.483 . . . . 0.0 110.501 -178.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 51.7 t -59.15 -43.41 89.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.137 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -57.25 -41.95 80.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.907 0.384 . . . . 0.0 110.673 -178.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.55 -46.27 94.64 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 -179.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 72.4 mt -58.55 -42.62 88.29 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.943 0.401 . . . . 0.0 110.662 -179.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 48.1 mt -60.28 -40.39 90.27 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.82 -179.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 25.1 pttt -88.53 3.2 51.12 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 49.9 m -120.66 143.27 48.8 Favored 'General case' 0 C--O 1.231 0.116 0 O-C-N 122.021 -0.424 . . . . 0.0 110.42 179.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 59.4 mttp . . . . . 0 C--O 1.22 -0.45 0 CA-C-O 117.914 -1.041 . . . . 0.0 110.511 -179.837 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.277 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -49.59 148.18 12.01 Favored 'Trans proline' 0 N--CA 1.496 1.664 0 CA-C-N 118.861 1.33 . . . . 0.0 112.001 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 97.4 mm-40 -99.08 143.04 29.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.563 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -67.38 153.83 94.08 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.547 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -70.03 -33.77 14.94 Favored 'Trans proline' 0 N--CA 1.494 1.546 0 C-N-CA 121.32 1.347 . . . . 0.0 112.057 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 78.7 mt -62.29 -40.34 95.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.743 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.3 mt -100.11 122.98 43.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.551 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -144.66 -44.91 0.24 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.482 179.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -59.42 -37.91 79.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.072 -179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -56.99 147.41 24.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.828 0.347 . . . . 0.0 110.747 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 38.3 ptt85 -71.43 133.07 45.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.935 -179.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.62 160.53 26.89 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.469 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -50.09 136.63 37.55 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 121.322 1.348 . . . . 0.0 111.751 179.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -103.21 150.03 37.52 Favored Pre-proline 0 C--O 1.236 0.356 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.779 -178.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 30.1 Cg_exo -57.9 128.96 30.98 Favored 'Trans proline' 0 N--CA 1.496 1.637 0 C-N-CA 121.032 1.155 . . . . 0.0 111.698 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 74.92 25.07 70.21 Favored Glycine 0 CA--C 1.531 1.057 0 CA-C-N 116.09 -0.504 . . . . 0.0 112.617 177.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 25.9 pt20 -52.02 150.31 4.43 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 117.762 0.781 . . . . 0.0 111.292 175.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 7.2 ttt -61.17 138.95 94.5 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-O 119.03 -0.509 . . . . 0.0 110.531 -175.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -76.3 160.88 35.52 Favored 'Trans proline' 0 N--CA 1.495 1.575 0 C-N-CA 121.396 1.397 . . . . 0.0 111.878 177.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -101.96 109.26 20.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.504 178.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 13.5 mt -64.16 151.6 89.96 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.329 -0.396 . . . . 0.0 109.954 179.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -79.11 139.86 15.35 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 C-N-CA 121.229 1.286 . . . . 0.0 111.339 175.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 27.5 mmtp -97.13 125.76 44.69 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 118.889 -0.577 . . . . 0.0 110.225 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -74.09 155.72 47.33 Favored 'Trans proline' 0 N--CA 1.495 1.613 0 C-N-CA 121.429 1.419 . . . . 0.0 111.704 172.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -51.73 154.76 8.91 Favored 'Trans proline' 0 N--CA 1.494 1.554 0 C-N-CA 121.361 1.374 . . . . 0.0 111.783 178.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 26.0 tp -49.91 -29.17 7.76 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -177.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 64.7 t80 -54.93 -37.12 66.0 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.898 0.38 . . . . 0.0 111.228 -176.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 34.2 t90 -60.55 -48.14 83.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.261 -177.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -62.58 -48.8 77.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.119 0.485 . . . . 0.0 110.57 -177.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -59.2 -42.62 91.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.938 -176.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -59.12 -48.52 81.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.861 0.362 . . . . 0.0 110.594 -176.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.63 -48.94 79.71 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.601 -177.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -59.64 -41.6 90.85 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.174 -176.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 48.7 tptt -64.01 -47.42 80.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.093 -177.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -55.24 -48.92 73.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.204 -178.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -65.04 -35.24 80.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.501 179.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -85.72 125.41 33.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.843 0.354 . . . . 0.0 110.895 -178.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 5.7 mp . . . . . 0 C--O 1.221 -0.445 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.469 179.491 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.344 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_exo -48.82 149.47 7.61 Favored 'Trans proline' 0 N--CA 1.497 1.706 0 C-N-CA 121.323 1.349 . . . . 0.0 112.168 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -91.49 10.01 29.54 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 43.9 ttm -84.55 119.52 25.28 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-N 118.037 0.38 . . . . 0.0 110.576 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -94.27 103.2 15.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.63 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 23.5 p-10 -64.83 -38.62 91.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.03 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 20.7 tp -56.55 -40.07 74.49 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.781 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.0 ttm -91.88 124.55 36.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.599 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.21 144.48 55.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.473 179.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.0 p30 -168.83 -175.1 2.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.821 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -59.94 -32.77 71.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.54 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.5 m -55.85 -39.57 71.62 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.899 0.38 . . . . 0.0 110.768 -178.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mm -60.29 -47.08 93.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.991 0.424 . . . . 0.0 110.051 -178.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 35.3 m -58.98 -44.62 91.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.448 -177.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -59.22 -45.0 92.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.608 -178.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 44.1 ttm -58.34 -44.01 88.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.025 0.44 . . . . 0.0 110.319 -178.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 29.7 m120 -60.13 -49.62 76.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.271 -178.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.8 tp -59.62 -33.25 71.27 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.066 -178.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.04 -50.35 70.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.632 0.254 . . . . 0.0 110.798 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.04 -41.77 83.97 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.018 0.437 . . . . 0.0 110.455 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 94.9 mt -54.16 -52.96 32.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.66 178.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -52.51 -23.69 6.7 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -178.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.1 tttm -59.0 -33.65 70.95 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 -177.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.9 mm -109.89 -42.9 5.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.942 0.401 . . . . 0.0 110.204 -177.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -116.85 80.07 10.66 Favored Pre-proline 0 CA--C 1.535 0.375 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.341 -176.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -54.2 -22.59 26.43 Favored 'Trans proline' 0 N--CA 1.498 1.741 0 C-N-CA 121.533 1.489 . . . . 0.0 113.379 -176.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -92.1 14.42 16.04 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 -174.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -91.78 121.46 33.43 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 173.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -104.37 -39.83 6.31 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.135 -172.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -134.31 147.72 50.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.099 -176.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 22.6 mt -99.6 133.25 43.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 172.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.8 t -92.48 -47.25 14.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.983 179.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -153.07 151.15 29.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.84 178.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.1 p -139.02 132.04 29.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.059 0.457 . . . . 0.0 110.925 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.6 t -106.28 125.83 51.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.63 176.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.7 m -54.04 -37.85 64.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.241 -173.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 64.6 t-80 -151.52 126.94 10.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.331 0.586 . . . . 0.0 111.737 -179.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 94.8 t -144.97 140.83 23.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.399 -178.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.48 149.92 51.05 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.211 -177.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -98.32 131.96 44.19 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.35 0.595 . . . . 0.0 111.889 -176.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -124.58 143.18 50.84 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.6 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 86.1 m -121.94 144.76 48.68 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -106.5 131.96 53.07 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.881 0.372 . . . . 0.0 110.116 175.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 -103.62 115.05 29.79 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.828 177.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.7 t -67.93 -32.56 73.1 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.958 -176.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.4 m -60.29 -39.06 85.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.663 0.268 . . . . 0.0 110.996 -177.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -95.82 -21.46 18.09 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 69.71 44.37 0.87 Allowed 'General case' 0 C--O 1.232 0.181 0 CA-C-O 121.402 0.62 . . . . 0.0 109.697 -178.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -150.4 162.68 40.09 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.143 -177.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 85.3 m95 -94.94 140.08 30.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.403 178.24 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -122.26 130.33 53.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.076 177.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.9 pttp -75.43 139.27 42.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.293 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.7 p -92.33 169.4 10.61 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.651 -0.419 . . . . 0.0 109.95 178.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.1 p30 -85.79 13.11 7.73 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 177.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 40.2 t -104.11 106.44 20.32 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-O 121.025 0.441 . . . . 0.0 110.313 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -130.76 114.59 15.54 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 176.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -161.94 176.47 38.38 Favored Glycine 0 CA--C 1.519 0.338 0 C-N-CA 120.099 -1.048 . . . . 0.0 112.451 -169.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -79.71 136.28 36.74 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 175.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -101.44 123.5 45.6 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 120.952 -0.299 . . . . 0.0 110.23 -176.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -128.25 141.16 51.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.629 0.252 . . . . 0.0 110.658 177.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.415 HD13 HG22 ' A' ' 54' ' ' ILE . 74.6 mt -101.5 127.06 55.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 171.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 12.3 m-30 -108.55 138.94 44.03 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.956 0.408 . . . . 0.0 111.346 -177.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 61.5 t60 -108.81 143.38 38.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.912 174.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 64.3 ttt180 -140.47 145.85 37.46 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.025 177.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.9 m120 -86.97 28.18 0.94 Allowed 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.268 -0.423 . . . . 0.0 112.045 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.31 166.09 33.17 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 179.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -64.05 127.91 92.4 Favored Pre-proline 0 CA--C 1.54 0.574 0 CA-C-O 118.463 -0.779 . . . . 0.0 109.949 -177.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -75.66 140.98 69.52 Favored 'Cis proline' 0 N--CA 1.497 1.702 0 CA-C-N 121.835 1.691 . . . . 0.0 111.741 -1.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -62.73 -41.87 99.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.955 -177.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 73.5 m80 -143.25 139.55 30.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.359 0.6 . . . . 0.0 110.908 -177.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.4 t -149.99 151.76 33.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.345 -178.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 51.7 mt -114.68 138.92 43.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 -177.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -131.82 142.16 49.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.391 -178.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.5 mt -121.07 129.63 75.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.248 0.547 . . . . 0.0 109.738 172.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -97.21 99.54 11.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.492 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -73.31 106.06 4.97 Favored 'General case' 0 C--N 1.332 -0.188 0 O-C-N 123.702 0.626 . . . . 0.0 111.013 -175.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.2 ttm180 -72.85 -43.39 62.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.416 -171.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 52.6 mt -70.3 -45.25 66.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.605 -174.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 39.0 m-20 -95.1 -3.17 48.57 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -175.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 67.4 p 51.63 43.15 30.01 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.55 0.69 . . . . 0.0 110.996 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.1 m -124.85 142.02 51.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.277 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.3 p -88.58 133.66 34.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.389 -178.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -123.69 122.09 37.19 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 175.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.8 p -125.57 147.34 30.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 120.836 0.35 . . . . 0.0 111.109 -178.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -149.8 126.49 5.31 Favored Pre-proline 0 CA--C 1.539 0.534 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.203 175.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -75.39 150.91 37.17 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 121.371 1.38 . . . . 0.0 112.067 178.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 64.9 mt -89.78 115.81 30.03 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.328 179.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 66.0 p -97.92 159.01 15.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.94 176.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -95.4 24.96 26.79 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.817 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.3 p -111.07 -10.9 14.33 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 175.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.0 mt -67.96 135.16 51.94 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.856 0.36 . . . . 0.0 111.423 -175.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -111.05 135.92 50.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.768 175.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 66.6 mt -113.91 161.15 17.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.998 0.428 . . . . 0.0 111.056 -175.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -150.04 140.93 22.82 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 177.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.2 t -102.27 109.2 20.81 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.582 -0.447 . . . . 0.0 111.046 -178.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -106.82 103.75 48.52 Favored Pre-proline 0 C--N 1.329 -0.301 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 170.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -69.56 141.85 47.16 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 CA-C-N 120.654 1.269 . . . . 0.0 111.811 -172.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -90.08 11.94 57.5 Favored 'Cis proline' 0 N--CA 1.499 1.816 0 CA-C-N 121.068 1.417 . . . . 0.0 113.628 -3.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -90.86 169.54 10.84 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.686 0.279 . . . . 0.0 110.765 -178.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 50.7 tp -118.77 134.66 54.98 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 171.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.3 tp -125.58 140.37 52.79 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.637 0.256 . . . . 0.0 110.426 -175.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 22.2 p90 -145.42 155.09 42.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.787 0.327 . . . . 0.0 110.239 175.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.1 mtm105 -101.98 147.75 26.18 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.877 0.37 . . . . 0.0 110.624 -177.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -128.85 165.65 20.58 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.731 0.777 . . . . 0.0 111.523 -176.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -47.11 146.93 1.6 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.553 -0.748 . . . . 0.0 112.285 -177.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 63.33 30.92 15.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.227 179.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.5 p 66.26 35.25 6.05 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.729 0.3 . . . . 0.0 111.685 166.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -98.87 152.78 19.37 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 86.5 mt -115.46 126.96 73.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -178.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -133.92 150.24 51.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.58 178.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.6 167.38 25.89 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 111.351 -0.7 . . . . 0.0 111.351 -176.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -125.38 139.53 53.59 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.517 -0.341 . . . . 0.0 110.663 -179.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 7.6 t90 -107.16 125.72 51.46 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.417 174.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -113.52 141.8 46.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.792 0.329 . . . . 0.0 110.625 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -51.43 -35.32 38.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.691 178.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.2 t-20 -137.38 136.75 38.17 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.755 0.312 . . . . 0.0 110.403 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 25.1 m -61.38 -42.56 98.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.107 -177.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -57.84 -43.2 85.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.368 0.604 . . . . 0.0 110.106 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -57.03 -45.9 82.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.869 178.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 43.0 t -59.6 -37.74 79.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.889 178.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -61.73 -50.08 73.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.656 0.265 . . . . 0.0 110.856 -175.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -61.65 -44.75 96.38 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.987 -176.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 23.1 mm -59.52 -46.86 92.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 19.3 m -58.55 -44.62 89.71 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.563 -177.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.39 -43.33 93.91 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 -178.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.7 mt -58.25 -49.45 77.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.143 0.497 . . . . 0.0 110.489 -178.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 54.5 t -58.8 -43.87 89.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.171 -177.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -59.05 -42.3 89.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.825 -178.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.94 -41.94 99.7 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 111.407 -0.677 . . . . 0.0 111.407 -178.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 20.8 mt -63.67 -43.54 96.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.788 0.328 . . . . 0.0 111.181 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 66.9 mt -63.05 -44.88 94.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.437 -176.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 33.0 pttt -71.65 -37.52 70.81 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.754 -0.378 . . . . 0.0 111.28 -177.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 71.2 p -89.75 159.87 16.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.912 0.387 . . . . 0.0 110.519 -179.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 67.7 tttt . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 117.968 -1.015 . . . . 0.0 110.548 179.889 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.39 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -69.38 144.53 56.36 Favored 'Trans proline' 0 N--CA 1.495 1.592 0 C-N-CA 121.296 1.331 . . . . 0.0 111.97 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -101.44 152.31 20.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.625 -179.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 14.9 p30 -67.01 155.46 90.18 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.64 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -78.38 -0.94 11.16 Favored 'Trans proline' 0 N--CA 1.496 1.649 0 C-N-CA 121.331 1.354 . . . . 0.0 113.882 -179.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 21.4 tp -56.73 -42.01 78.47 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.825 0.345 . . . . 0.0 110.554 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 27.8 tp -64.74 -39.08 93.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.899 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 98.3 mm-40 -60.0 131.5 51.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.835 0.35 . . . . 0.0 110.748 -179.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.83 -39.23 93.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.891 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -56.94 145.85 28.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.862 0.363 . . . . 0.0 110.7 -179.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 68.4 ttt180 -74.62 137.85 42.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.491 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -71.92 157.06 90.24 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.695 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -68.26 133.19 27.78 Favored 'Trans proline' 0 N--CA 1.496 1.672 0 C-N-CA 121.272 1.315 . . . . 0.0 111.919 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 47.7 t80 -104.06 140.19 20.83 Favored Pre-proline 0 CA--C 1.532 0.272 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.909 -179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -57.92 128.95 30.92 Favored 'Trans proline' 0 N--CA 1.497 1.705 0 C-N-CA 121.053 1.169 . . . . 0.0 111.558 -179.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 103.42 -5.2 48.28 Favored Glycine 0 CA--C 1.535 1.316 0 CA-C-O 119.509 -0.606 . . . . 0.0 113.348 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -77.23 137.61 38.93 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 118.324 1.062 . . . . 0.0 110.225 176.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 4.3 ttp -68.44 133.65 91.03 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-O 118.717 -0.659 . . . . 0.0 110.003 -178.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -56.16 144.06 82.12 Favored 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 121.133 1.222 . . . . 0.0 111.506 175.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -99.14 101.22 12.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.608 -179.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 16.1 mt -66.72 147.1 99.12 Favored Pre-proline 0 C--N 1.329 -0.288 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 179.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -79.14 139.82 15.26 Favored 'Trans proline' 0 N--CA 1.491 1.351 0 C-N-CA 121.166 1.244 . . . . 0.0 111.215 174.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -97.2 125.78 44.46 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-O 118.796 -0.621 . . . . 0.0 109.861 178.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -75.09 163.43 35.15 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 121.425 1.417 . . . . 0.0 111.694 173.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.56 157.2 32.9 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 121.341 1.36 . . . . 0.0 111.341 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 26.4 tp -50.06 -27.61 5.85 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -176.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -54.61 -36.7 64.74 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.867 0.365 . . . . 0.0 111.294 -177.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 39.2 t90 -61.08 -48.13 83.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.247 -177.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -61.2 -46.35 90.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.051 0.453 . . . . 0.0 110.477 -178.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -59.35 -44.71 92.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.722 -177.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -58.28 -46.33 86.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.451 -176.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.07 -47.74 84.6 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.631 -178.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -58.33 -41.65 85.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.951 -177.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 23.2 tptm -64.42 -48.19 76.29 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.995 -178.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -54.92 -46.43 74.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.152 -178.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 42.8 tp10 -64.9 -37.01 86.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.076 178.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -63.99 148.82 48.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.76 0.314 . . . . 0.0 110.607 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 78.1 mt . . . . . 0 C--O 1.22 -0.485 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.554 179.958 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.252 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.1 -32.32 48.77 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 CA-C-N 118.854 1.327 . . . . 0.0 112.167 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -61.29 -51.1 70.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.722 -179.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 64.8 mtt -140.82 145.88 36.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.54 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -97.28 141.86 29.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.651 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -140.28 100.19 3.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.425 179.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 79.1 mt -57.37 -43.27 83.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.653 -179.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.7 mtm -142.25 159.13 42.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.605 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -63.94 148.24 50.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.489 179.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -148.13 161.86 40.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.708 -179.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -59.85 -36.55 77.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.192 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.5 p -58.48 -37.86 76.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.756 0.312 . . . . 0.0 110.941 -178.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 43.7 mm -62.29 -40.78 89.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.372 179.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.9 m -63.49 -49.97 71.47 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.679 -176.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.7 ptt180 -61.88 -37.45 84.61 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.799 -178.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 44.0 ttm -58.68 -46.21 87.72 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.151 0.5 . . . . 0.0 110.143 179.252 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -59.67 -48.92 79.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.195 -178.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.3 tp -59.74 -32.97 71.06 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.651 -0.419 . . . . 0.0 111.177 -178.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.84 -50.53 70.59 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.654 0.264 . . . . 0.0 110.701 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.64 -41.74 86.7 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.43 179.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 95.3 mt -54.19 -52.94 33.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.649 178.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -54.15 -21.6 9.17 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -178.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -58.64 -33.96 70.66 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 111.727 0.269 . . . . 0.0 111.727 -178.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.6 mm -113.0 -40.15 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-O 120.722 0.296 . . . . 0.0 110.531 -177.015 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -117.05 77.38 8.99 Favored Pre-proline 0 CA--C 1.535 0.368 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.214 -178.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -55.39 -20.71 26.86 Favored 'Trans proline' 0 N--CA 1.498 1.76 0 C-N-CA 121.536 1.49 . . . . 0.0 113.459 -175.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.8 p90 -90.77 9.94 28.04 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -174.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -84.62 122.32 28.88 Favored 'General case' 0 C--O 1.231 0.11 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 174.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.4 ttpt -97.49 -40.54 8.61 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.887 -173.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -148.44 153.06 38.0 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.586 -0.445 . . . . 0.0 111.433 -178.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 29.9 mt -94.38 138.3 20.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.848 178.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.2 t -92.58 -47.17 14.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.839 177.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -152.88 155.06 36.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.019 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.8 p -141.86 132.02 24.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.044 0.449 . . . . 0.0 110.943 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.5 t -108.49 126.45 52.93 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.647 177.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.4 t -54.58 -38.85 67.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.28 -172.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -150.45 126.8 10.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.225 0.536 . . . . 0.0 111.558 -179.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 96.2 t -145.19 140.43 22.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.309 -177.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.64 149.76 51.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.725 0.298 . . . . 0.0 111.314 -177.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -98.63 130.83 45.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.27 -177.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -125.31 142.08 51.71 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.599 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 64.1 m -120.38 145.86 46.75 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 178.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -108.27 131.87 54.26 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 121.011 0.434 . . . . 0.0 110.433 176.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -104.11 115.45 30.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.888 177.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.0 t -67.63 -32.51 73.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.918 -177.307 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.1 t -60.44 -40.26 90.44 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.726 0.298 . . . . 0.0 110.82 -177.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 98.0 mm-40 -93.8 -21.36 19.34 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 69.66 43.48 0.98 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-O 121.436 0.636 . . . . 0.0 109.803 -177.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -151.51 162.97 40.05 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.037 -177.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 89.0 m95 -94.33 141.76 28.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.336 177.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -124.01 130.42 52.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 0.0 109.958 176.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -72.42 139.21 47.65 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 177.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 77.3 p -92.35 179.04 5.66 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.298 -178.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -88.67 15.17 8.57 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -179.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.4 t -111.88 106.42 20.73 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 CA-C-O 120.982 0.42 . . . . 0.0 110.273 178.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -132.19 112.93 12.7 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 174.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.52 38.96 Favored Glycine 0 CA--C 1.52 0.4 0 C-N-CA 120.202 -0.999 . . . . 0.0 112.213 -168.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.47 135.95 37.49 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 174.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -101.26 127.04 48.03 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.346 -175.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -130.76 142.09 50.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.765 0.316 . . . . 0.0 110.308 177.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 66.3 mt -101.62 127.58 54.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 172.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 16.2 m-30 -108.48 137.62 46.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.997 0.427 . . . . 0.0 111.208 -175.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 30.1 t60 -116.7 143.31 45.79 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.967 175.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -141.22 147.43 38.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.141 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -86.9 28.1 0.93 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.275 -0.421 . . . . 0.0 112.125 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.72 160.5 37.97 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 178.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -64.05 131.78 95.08 Favored Pre-proline 0 CA--C 1.539 0.547 0 CA-C-O 118.536 -0.745 . . . . 0.0 110.04 -176.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -71.13 140.88 67.16 Favored 'Cis proline' 0 N--CA 1.498 1.792 0 CA-C-N 121.701 1.643 . . . . 0.0 111.515 -1.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -65.22 -42.73 93.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.028 -177.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -143.52 140.97 30.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.494 0.664 . . . . 0.0 111.038 -177.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.3 t -150.42 152.39 34.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.211 -178.024 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 46.5 mt -112.58 138.13 42.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -178.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 79.2 t80 -131.83 142.02 49.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.972 -176.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.0 mt -123.62 133.23 69.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.18 0.514 . . . . 0.0 109.847 172.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -99.16 99.55 10.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.37 179.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -72.42 106.95 4.74 Favored 'General case' 0 C--N 1.332 -0.193 0 O-C-N 123.666 0.604 . . . . 0.0 111.092 -175.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 55.6 ttp180 -72.86 -41.04 65.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.198 -171.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 75.5 mt -70.51 -45.16 66.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.684 -175.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -95.01 -3.34 48.57 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -175.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.0 m 55.87 43.1 28.11 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 121.452 0.644 . . . . 0.0 110.57 177.064 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.6 m -131.78 149.03 52.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.229 -178.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.0 p -101.71 141.82 33.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.929 0.395 . . . . 0.0 110.933 -179.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -135.45 122.13 20.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.231 178.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.8 p -125.49 148.53 30.02 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-O 120.807 0.337 . . . . 0.0 111.035 -177.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -147.17 136.27 11.48 Favored Pre-proline 0 CA--C 1.537 0.456 0 CA-C-O 119.03 -0.509 . . . . 0.0 110.487 174.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.51 150.87 36.61 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 121.673 1.582 . . . . 0.0 112.411 179.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 68.8 mt -89.96 137.25 21.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.902 0.382 . . . . 0.0 110.165 177.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 61.6 p -132.15 159.47 38.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.866 177.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -95.79 36.04 4.03 Favored Glycine 0 CA--C 1.524 0.653 0 C-N-CA 120.845 -0.693 . . . . 0.0 111.914 -178.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.2 t -109.22 -21.97 12.31 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 174.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 74.8 mt -68.49 144.93 54.47 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-O 120.949 0.404 . . . . 0.0 111.492 -176.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 54.2 tt0 -114.78 135.87 53.71 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.715 175.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 67.6 mt -115.16 158.09 22.72 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.057 0.456 . . . . 0.0 111.11 -175.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -149.54 141.02 23.34 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 177.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.4 t -98.13 109.09 21.9 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.399 -0.521 . . . . 0.0 110.578 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -106.83 103.68 48.22 Favored Pre-proline 0 C--N 1.328 -0.355 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 172.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -71.41 142.22 40.41 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 CA-C-N 120.596 1.249 . . . . 0.0 112.025 -171.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -90.56 13.72 52.58 Favored 'Cis proline' 0 N--CA 1.499 1.844 0 CA-C-N 121.075 1.42 . . . . 0.0 113.541 -3.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -93.04 172.98 7.97 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 122.149 0.179 . . . . 0.0 110.721 -177.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 58.7 tp -115.94 135.7 53.73 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 171.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.2 tp -127.15 139.63 52.83 Favored 'General case' 0 C--N 1.334 -0.096 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 -174.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 9.4 p90 -148.84 153.79 38.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.951 0.405 . . . . 0.0 110.659 176.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 31.6 mtm180 -102.43 149.21 24.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.81 -176.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -129.73 166.53 19.68 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.791 0.805 . . . . 0.0 111.464 -177.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -47.77 145.01 3.01 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.249 -176.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 65.24 31.01 11.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.093 179.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 37.8 t 66.29 35.14 6.06 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.912 0.387 . . . . 0.0 111.578 166.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -98.25 152.77 19.06 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 179.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 78.0 mt -115.77 126.28 73.24 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 CA-C-O 121.061 0.458 . . . . 0.0 109.993 -177.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 85.7 mmt-85 -127.95 149.4 50.35 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.276 178.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -140.54 164.69 26.27 Favored Glycine 0 CA--C 1.522 0.517 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 -178.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 32.9 m-85 -125.35 136.65 53.67 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.442 -0.379 . . . . 0.0 110.856 -178.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -107.41 126.35 52.38 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.735 175.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -117.84 142.67 47.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.799 0.333 . . . . 0.0 110.51 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -51.15 -34.72 32.37 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.769 178.252 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -137.62 136.92 37.96 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.767 0.318 . . . . 0.0 110.469 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.0 p -61.69 -40.48 95.15 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.161 -177.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -59.72 -43.67 94.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.407 0.622 . . . . 0.0 110.095 178.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -56.73 -45.32 82.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.979 179.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 43.0 t -60.22 -39.69 87.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.728 178.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -59.21 -45.65 90.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.77 0.319 . . . . 0.0 110.562 -176.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -60.62 -49.04 79.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.744 -177.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 31.6 mm -58.46 -44.98 90.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.039 -178.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 68.1 p -59.74 -44.37 93.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.767 -177.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.7 -43.79 94.32 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 110.678 -0.969 . . . . 0.0 110.678 -178.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.2 mt -59.06 -48.72 80.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.034 0.445 . . . . 0.0 110.506 -178.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 53.3 t -58.82 -43.24 87.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.168 -178.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -57.97 -43.0 86.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.681 -178.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.5 -42.77 99.67 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.407 -0.677 . . . . 0.0 111.407 -178.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 34.4 mt -63.94 -40.74 97.14 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.765 0.317 . . . . 0.0 111.403 -179.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 29.8 mt -62.8 -38.18 89.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.687 -176.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 32.7 pttt -84.3 -34.38 23.75 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.875 -175.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 49.2 m -110.68 143.59 40.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.857 0.36 . . . . 0.0 110.936 -177.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm . . . . . 0 C--O 1.22 -0.476 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.567 179.819 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -49.05 144.46 15.94 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 121.37 1.38 . . . . 0.0 112.034 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -100.14 144.65 28.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.505 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 21.8 p-10 -70.32 153.42 95.18 Favored Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.6 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -83.33 159.95 15.05 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 121.544 1.496 . . . . 0.0 112.219 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 29.9 tp -56.92 -41.04 77.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.634 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 22.8 tp -101.04 124.53 46.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.51 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 52.7 tp60 -102.27 111.69 24.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.594 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -66.94 -39.85 87.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.888 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -89.7 157.34 18.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.729 -178.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 59.8 ttt85 -84.78 127.15 33.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.582 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.6 159.5 30.64 Favored Pre-proline 0 CA--C 1.532 0.263 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.459 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -68.16 145.12 65.64 Favored 'Trans proline' 0 N--CA 1.496 1.658 0 C-N-CA 121.233 1.289 . . . . 0.0 111.768 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -96.6 152.13 38.38 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.691 -179.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -57.98 129.0 31.07 Favored 'Trans proline' 0 N--CA 1.496 1.623 0 C-N-CA 121.093 1.195 . . . . 0.0 111.502 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 98.61 -2.17 58.71 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 121.05 -0.595 . . . . 0.0 113.403 179.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -52.02 133.75 32.67 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 118.426 1.113 . . . . 0.0 111.378 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 6.6 ttt -69.5 118.16 59.78 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-O 118.624 -0.703 . . . . 0.0 110.461 -178.364 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -59.28 152.88 57.15 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 C-N-CA 121.14 1.227 . . . . 0.0 111.621 175.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 7.5 p30 -98.59 114.84 27.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.745 -179.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 15.4 mt -71.19 153.63 94.23 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.123 178.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.05 139.96 15.51 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 C-N-CA 121.154 1.236 . . . . 0.0 111.145 174.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -97.12 125.83 44.47 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-O 118.782 -0.628 . . . . 0.0 109.97 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -77.79 154.9 30.57 Favored 'Trans proline' 0 N--CA 1.494 1.52 0 C-N-CA 121.415 1.41 . . . . 0.0 111.438 173.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -50.54 151.18 10.64 Favored 'Trans proline' 0 N--CA 1.496 1.647 0 C-N-CA 121.263 1.309 . . . . 0.0 111.747 178.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 79.5 mt -49.94 -25.83 3.62 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 -177.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -55.54 -38.49 69.35 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.904 0.383 . . . . 0.0 111.059 -177.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 33.3 t90 -61.81 -48.11 82.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.269 -176.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 37.6 tt0 -61.37 -48.2 82.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.073 0.463 . . . . 0.0 110.532 -177.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -59.86 -45.32 92.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 -177.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -58.76 -46.45 87.44 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.669 -176.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.53 -48.43 81.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.765 -177.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -59.06 -42.29 89.95 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.104 -176.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 48.9 tttm -64.93 -48.1 75.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.139 -177.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 55.5 tp60 -55.01 -47.97 73.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.139 -178.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -64.91 -37.08 86.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.095 179.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -70.06 153.93 42.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.83 0.347 . . . . 0.0 110.558 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 23.7 tp . . . . . 0 C--O 1.221 -0.44 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.475 179.925 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.267 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -52.38 -30.71 44.46 Favored 'Trans proline' 0 N--CA 1.497 1.712 0 CA-C-N 119.558 1.679 . . . . 0.0 112.304 177.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -55.63 -39.81 71.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.944 -179.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 71.5 mtm -82.08 134.07 35.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.663 -179.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -75.23 174.63 9.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.4 179.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 26.3 p-10 -71.26 104.78 3.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.305 0.574 . . . . 0.0 110.68 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 28.9 tp -69.09 -39.88 78.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.824 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.2 mmm -75.82 135.0 40.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.479 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.24 172.84 12.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.511 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.32 153.19 27.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.658 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -59.54 -35.97 75.24 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.139 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.8 t -56.57 -40.47 75.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.892 0.377 . . . . 0.0 110.659 -178.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.0 mm -60.09 -45.71 95.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.215 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.2 m -59.24 -45.66 90.57 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.024 0.44 . . . . 0.0 110.509 -177.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -59.38 -44.57 92.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.574 -178.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 44.5 ttm -58.26 -43.53 87.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.102 0.477 . . . . 0.0 110.463 -178.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -60.06 -49.5 77.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.299 -178.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 13.7 tp -61.32 -30.86 70.76 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.394 -179.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.85 -50.17 71.99 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.745 0.307 . . . . 0.0 110.619 178.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.44 -41.49 85.24 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.945 0.402 . . . . 0.0 110.392 178.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 95.5 mt -54.22 -52.95 33.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.659 178.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -53.3 -24.29 11.29 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -178.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -59.87 -33.52 71.93 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -177.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.5 mm -108.34 -40.69 4.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.787 0.327 . . . . 0.0 110.532 -176.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -114.78 84.94 10.89 Favored Pre-proline 0 CA--C 1.533 0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.713 -176.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -53.51 -22.97 23.33 Favored 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 121.522 1.482 . . . . 0.0 113.194 -178.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.4 p90 -97.98 22.06 9.84 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -175.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -101.81 121.23 41.7 Favored 'General case' 0 C--O 1.231 0.105 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 171.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 51.1 tptt -110.95 -38.15 5.18 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.761 0.315 . . . . 0.0 111.272 -173.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -130.02 144.82 51.54 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.808 -176.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 59.4 mt -98.7 129.21 49.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.83 173.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.1 t -90.46 -47.11 14.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 0.0 109.914 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -153.37 152.13 30.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.129 178.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.7 p -140.82 131.96 26.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.992 0.425 . . . . 0.0 110.775 178.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.9 t -107.02 129.18 54.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.901 177.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.3 m -54.41 -38.3 66.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.269 -172.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 -152.41 127.53 9.77 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.323 0.583 . . . . 0.0 111.91 -178.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 98.4 t -145.2 140.69 22.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.466 -178.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.41 149.83 50.38 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.159 -178.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -97.03 132.78 42.49 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.204 0.526 . . . . 0.0 111.723 -177.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -128.16 142.85 51.06 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.668 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.3 m -121.5 148.09 44.92 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 177.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -112.48 131.69 55.45 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-O 120.865 0.364 . . . . 0.0 110.357 177.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -102.01 113.78 27.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.775 176.332 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 85.6 p -68.56 -31.02 69.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.074 -177.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.2 m -62.6 -38.58 90.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.667 0.27 . . . . 0.0 110.928 -177.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -94.68 -21.41 18.79 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -178.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 69.58 45.66 0.78 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.463 0.649 . . . . 0.0 109.434 -177.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 -151.89 149.69 29.24 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.233 -177.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 82.7 m95 -86.98 142.46 27.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.199 176.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -123.78 126.29 46.21 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 175.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -75.51 140.35 42.73 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 178.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.8 p -92.29 170.72 9.57 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.144 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -84.37 12.43 6.77 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 178.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 40.4 t -104.39 106.48 20.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-O 120.969 0.414 . . . . 0.0 110.215 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -130.7 116.1 17.57 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 176.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.55 176.39 38.89 Favored Glycine 0 CA--C 1.521 0.443 0 C-N-CA 120.081 -1.056 . . . . 0.0 112.441 -169.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -80.22 136.63 36.51 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 175.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -101.8 125.31 48.44 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.293 -175.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -129.46 141.57 50.99 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.791 0.329 . . . . 0.0 110.712 177.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 67.9 mt -101.58 126.38 55.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 171.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 11.6 m-30 -108.57 138.05 45.51 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.892 0.377 . . . . 0.0 111.335 -177.261 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 61.9 t60 -111.6 143.25 42.78 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.871 173.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 13.4 tpt180 -142.22 147.71 36.97 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.884 177.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -86.9 28.18 0.93 Allowed 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.73 171.3 20.33 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.1 mp0 -63.99 124.38 85.01 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.003 -178.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -79.41 140.97 59.01 Favored 'Cis proline' 0 N--CA 1.497 1.685 0 CA-C-N 121.937 1.728 . . . . 0.0 111.926 -0.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -63.2 -44.26 95.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.941 -177.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -143.32 135.86 27.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.307 0.575 . . . . 0.0 110.837 -177.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.4 t -149.6 150.91 32.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.572 -177.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 57.7 mt -114.32 137.46 47.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 -178.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -131.94 142.16 49.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.581 -177.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.5 mt -120.05 129.41 75.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.247 0.546 . . . . 0.0 109.729 172.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -96.58 99.52 11.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.531 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.2 t-20 -71.23 105.45 3.45 Favored 'General case' 0 N--CA 1.462 0.151 0 O-C-N 123.642 0.589 . . . . 0.0 110.971 -175.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -73.1 -42.43 62.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.235 -171.052 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 60.4 mt -70.9 -45.21 64.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.624 -174.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 54.8 m-20 -95.11 -3.27 48.36 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -175.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.0 m 55.71 43.52 27.83 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 121.452 0.644 . . . . 0.0 110.452 177.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.6 m -125.16 148.87 48.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.52 -178.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.3 p -97.3 132.53 42.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.346 -179.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -123.59 122.1 37.29 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.8 p -125.54 147.68 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-O 120.751 0.31 . . . . 0.0 111.237 -178.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -149.77 126.55 5.34 Favored Pre-proline 0 CA--C 1.537 0.473 0 CA-C-O 118.665 -0.684 . . . . 0.0 110.213 174.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -75.27 150.94 37.71 Favored 'Trans proline' 0 N--CA 1.498 1.765 0 C-N-CA 121.46 1.44 . . . . 0.0 112.265 178.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 67.0 mt -90.65 138.92 18.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.929 0.395 . . . . 0.0 110.302 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.4 p -132.1 155.65 47.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.706 177.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -94.04 36.68 3.65 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.002 -178.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.9 m -111.12 -22.97 11.17 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 173.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.7 mt -69.13 146.44 52.51 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 120.898 0.38 . . . . 0.0 111.373 -176.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.3 tt0 -115.78 135.93 53.54 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.662 175.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.1 mt -112.03 158.58 19.38 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.07 0.462 . . . . 0.0 111.058 -176.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -147.87 140.22 24.4 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.957 -0.756 . . . . 0.0 108.957 177.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.1 t -106.94 109.34 21.21 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.386 -177.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -106.83 103.68 48.25 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 169.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.1 145.25 78.48 Favored 'Trans proline' 0 N--CA 1.498 1.779 0 CA-C-N 120.391 1.175 . . . . 0.0 112.037 -170.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -92.61 17.53 41.6 Favored 'Cis proline' 0 N--CA 1.499 1.84 0 CA-C-N 120.893 1.355 . . . . 0.0 113.346 -3.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -104.89 162.11 13.61 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 110.337 -0.246 . . . . 0.0 110.337 -177.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 32.8 tp -115.72 133.48 55.99 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 122.062 -0.399 . . . . 0.0 111.177 -179.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.5 tp -122.53 140.42 52.79 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.252 -175.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -142.89 154.96 44.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.768 0.318 . . . . 0.0 110.492 176.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.8 mtm105 -101.96 146.65 27.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.71 -178.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -127.14 163.4 23.9 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.668 0.746 . . . . 0.0 111.414 -177.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 31.6 mp0 -48.33 147.17 2.44 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.112 -177.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 64.31 30.96 13.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.118 -0.946 . . . . 0.0 112.176 179.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 48.9 m 67.29 35.24 4.48 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.901 0.381 . . . . 0.0 111.631 165.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -99.82 151.36 21.37 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 178.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 76.4 mt -114.71 126.51 72.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -178.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -137.21 149.72 47.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.13 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -147.39 169.42 28.34 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.001 -175.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -125.16 136.81 53.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.364 -0.418 . . . . 0.0 110.415 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 46.2 t90 -104.47 125.17 50.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.509 176.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -112.22 140.91 46.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.733 -177.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -51.49 -40.78 60.21 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.81 179.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -129.06 136.55 50.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.671 0.272 . . . . 0.0 110.462 -179.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.2 p -63.14 -41.52 99.3 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.309 -177.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -60.38 -44.81 95.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.514 0.673 . . . . 0.0 109.985 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -55.98 -43.48 77.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.206 178.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 51.6 t -59.35 -41.46 89.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.527 177.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -58.65 -44.59 90.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.618 -176.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -60.56 -49.33 77.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.748 -177.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 30.4 mm -58.29 -45.91 89.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.099 0.476 . . . . 0.0 110.077 -178.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 78.0 p -59.99 -43.5 95.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.702 -177.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.66 -43.27 94.44 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.68 -0.968 . . . . 0.0 110.68 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 10.6 mt -59.83 -49.8 76.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.017 0.436 . . . . 0.0 110.686 -178.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 59.0 t -59.01 -42.67 86.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.148 -178.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -58.45 -43.03 88.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.861 0.362 . . . . 0.0 110.639 -178.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.25 -40.58 98.78 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.335 -0.706 . . . . 0.0 111.335 -179.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 34.8 mt -63.08 -42.97 99.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.794 0.33 . . . . 0.0 111.077 178.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 40.5 mt -63.17 -44.85 94.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.435 -177.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 12.6 pttp -73.07 -34.44 66.24 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.831 -0.348 . . . . 0.0 111.743 -176.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 28.6 t -93.94 145.6 24.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.881 0.372 . . . . 0.0 110.698 -178.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 57.4 tttp . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.498 179.858 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.411 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -50.71 141.92 33.54 Favored 'Trans proline' 0 N--CA 1.495 1.573 0 C-N-CA 121.328 1.352 . . . . 0.0 112.032 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -121.94 147.26 46.25 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.396 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -67.63 157.74 85.1 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.424 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -71.16 -50.01 0.34 Allowed 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 121.257 1.304 . . . . 0.0 112.273 -178.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 94.6 mt -141.26 -68.53 0.39 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.669 -179.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.3 mt -98.45 152.42 19.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.728 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -134.67 148.59 50.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.499 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 98.1 mm-40 -93.59 -65.64 0.98 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.638 -179.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -135.64 157.36 47.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.594 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 49.9 ttt180 -98.57 132.11 44.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.439 179.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -95.3 154.11 39.5 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.666 -179.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -80.91 161.96 20.97 Favored 'Trans proline' 0 N--CA 1.492 1.422 0 C-N-CA 121.517 1.478 . . . . 0.0 111.961 179.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 27.6 p90 -131.23 155.97 80.78 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.496 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -57.77 128.88 30.82 Favored 'Trans proline' 0 N--CA 1.495 1.561 0 C-N-CA 121.136 1.224 . . . . 0.0 111.587 -179.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 102.2 -4.99 52.23 Favored Glycine 0 CA--C 1.534 1.269 0 CA-C-O 119.646 -0.53 . . . . 0.0 113.439 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -56.89 134.5 55.49 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 118.279 1.039 . . . . 0.0 110.437 177.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 6.0 ttt -75.39 135.03 72.78 Favored Pre-proline 0 CA--C 1.535 0.402 0 CA-C-O 118.699 -0.667 . . . . 0.0 110.326 -177.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -65.95 153.49 77.89 Favored 'Trans proline' 0 N--CA 1.496 1.669 0 C-N-CA 121.183 1.256 . . . . 0.0 111.684 175.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -104.96 110.25 22.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.426 178.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 13.9 mt -71.65 151.73 93.58 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.023 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -79.14 139.9 15.32 Favored 'Trans proline' 0 N--CA 1.491 1.361 0 C-N-CA 121.182 1.255 . . . . 0.0 111.221 174.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -97.06 125.77 44.78 Favored Pre-proline 0 CA--C 1.534 0.363 0 CA-C-O 118.721 -0.657 . . . . 0.0 109.997 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -72.57 155.43 54.76 Favored 'Trans proline' 0 N--CA 1.496 1.664 0 C-N-CA 121.383 1.389 . . . . 0.0 111.681 173.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.05 157.0 6.63 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 121.31 1.34 . . . . 0.0 111.613 178.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.3 tp -49.9 -29.94 9.18 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -177.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 56.8 t80 -55.15 -37.7 67.3 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.833 0.349 . . . . 0.0 111.207 -177.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 20.3 t90 -61.11 -48.14 83.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.256 -177.059 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -62.02 -47.83 83.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.007 0.432 . . . . 0.0 110.531 -177.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -59.33 -44.59 92.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.838 -177.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -58.99 -46.59 87.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.699 -176.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.09 -47.88 84.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.721 -177.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -59.02 -42.74 90.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.006 -176.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 63.0 tttm -64.29 -47.17 80.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.096 -177.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -54.93 -47.36 74.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.075 -178.374 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 42.4 tp10 -64.91 -36.98 86.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.114 178.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -63.34 150.42 43.44 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.824 0.345 . . . . 0.0 110.56 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 25.9 tp . . . . . 0 C--O 1.22 -0.494 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.552 -179.967 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.358 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -65.28 139.95 62.25 Favored 'Trans proline' 0 N--CA 1.497 1.683 0 CA-C-N 119.319 1.56 . . . . 0.0 111.961 -175.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -56.95 -40.94 77.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.759 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 85.5 mtp -89.62 158.08 17.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.681 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -140.75 156.46 46.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.564 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 76.0 m-20 -61.55 166.88 3.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.611 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 29.1 tp -55.95 -40.2 72.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.81 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.0 mmm -84.6 124.66 31.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.273 179.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.79 135.69 39.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.7 -179.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -102.42 167.6 9.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.363 179.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.5 mp0 -64.34 -40.56 96.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.73 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 87.0 p -58.26 -42.52 86.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.937 0.398 . . . . 0.0 110.377 -178.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mm -60.19 -45.2 96.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.215 -178.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.8 m -59.3 -44.45 92.52 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.525 -177.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -59.31 -45.99 89.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.542 -178.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.5 mtt -58.21 -44.18 88.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.126 0.489 . . . . 0.0 110.428 -178.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -60.09 -48.24 82.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.292 -178.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.8 tp -60.83 -32.35 71.74 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.193 -178.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.7 -50.2 72.09 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.668 0.27 . . . . 0.0 110.636 178.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.55 -41.91 86.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.031 0.443 . . . . 0.0 110.418 179.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 97.7 mt -54.17 -52.96 32.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.654 178.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -53.35 -23.42 9.37 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -59.53 -33.83 71.88 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -177.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.7 mm -108.5 -42.43 5.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.823 0.344 . . . . 0.0 110.173 -177.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -117.09 77.85 9.46 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.18 -177.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -55.04 -21.07 25.63 Favored 'Trans proline' 0 N--CA 1.498 1.753 0 C-N-CA 121.516 1.477 . . . . 0.0 113.529 -175.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.1 p90 -90.87 9.96 28.21 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.574 0.954 . . . . 0.0 113.574 -174.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.53 127.87 33.66 Favored 'General case' 0 C--O 1.231 0.123 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 175.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 69.1 tttt -97.46 -40.47 8.66 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.651 -176.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -157.93 155.81 30.18 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.679 -0.408 . . . . 0.0 111.38 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 37.0 mt -89.79 140.16 16.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.951 177.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.6 t -92.74 -47.13 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.83 176.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -156.49 158.97 38.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.884 178.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.5 p -143.24 134.58 26.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.162 0.506 . . . . 0.0 111.323 -179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 24.1 t -109.58 124.69 51.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.598 176.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.0 t -54.36 -38.88 66.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.302 -172.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -149.11 125.85 11.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.205 0.526 . . . . 0.0 111.81 -178.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 87.3 t -145.18 139.28 22.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 114.986 -1.006 . . . . 0.0 109.506 -177.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.04 149.83 50.7 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.041 -178.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -96.61 133.44 41.11 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.379 0.609 . . . . 0.0 111.884 -176.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -127.79 139.87 52.4 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.222 177.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 93.8 m -122.73 146.15 47.76 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -108.22 130.6 55.14 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.862 0.363 . . . . 0.0 110.317 176.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 29.9 t-20 -101.54 116.24 32.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.998 -0.547 . . . . 0.0 109.983 177.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.8 m -68.13 -33.05 73.77 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.902 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.0 p -62.23 -37.02 83.8 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.178 -177.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -95.56 -21.41 18.28 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -178.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 69.0 45.29 0.93 Allowed 'General case' 0 C--O 1.231 0.108 0 CA-C-O 121.424 0.631 . . . . 0.0 109.489 -177.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 32.0 tp10 -156.05 152.37 27.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.013 -177.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 85.2 m95 -86.78 143.67 27.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.296 176.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.7 tp10 -125.0 129.42 50.29 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 176.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 20.4 pttp -75.11 138.86 42.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.127 177.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.5 p -92.4 167.57 11.89 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.16 -178.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -82.94 12.29 5.11 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 178.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.1 t -101.29 106.53 19.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-O 120.962 0.41 . . . . 0.0 110.289 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -130.7 113.87 14.69 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 176.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.67 176.57 38.97 Favored Glycine 0 CA--C 1.52 0.391 0 C-N-CA 120.221 -0.99 . . . . 0.0 112.322 -169.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -80.91 134.93 35.82 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 175.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -98.51 129.64 45.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.849 0.356 . . . . 0.0 110.201 -176.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -132.96 143.53 49.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.237 177.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 69.0 mt -101.58 128.65 53.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 172.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 12.3 m-30 -108.58 135.78 49.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.843 0.354 . . . . 0.0 111.183 -175.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 50.1 t60 -118.34 143.26 46.75 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.238 176.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 60.0 ttt180 -141.97 147.92 37.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.147 178.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -86.83 28.07 0.93 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 178.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -159.1 167.36 29.4 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 -63.94 128.47 92.99 Favored Pre-proline 0 CA--C 1.538 0.509 0 CA-C-O 118.436 -0.793 . . . . 0.0 110.002 -178.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -74.94 140.93 70.08 Favored 'Cis proline' 0 N--CA 1.497 1.722 0 CA-C-N 121.943 1.729 . . . . 0.0 111.753 -1.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -65.45 -47.06 77.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.085 -177.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -142.69 137.37 29.83 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.431 0.634 . . . . 0.0 110.936 -176.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.0 t -151.14 152.28 33.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.45 -177.244 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 41.8 mt -107.04 141.61 21.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -131.74 141.93 49.65 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.371 -177.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.3 mt -128.38 131.42 69.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.25 0.548 . . . . 0.0 110.237 174.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -98.76 99.47 10.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 114.957 -1.019 . . . . 0.0 109.626 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -73.74 105.88 5.23 Favored 'General case' 0 N--CA 1.463 0.188 0 O-C-N 123.679 0.612 . . . . 0.0 110.717 -176.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 -73.64 -41.3 62.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.587 -170.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 66.5 mt -72.17 -45.21 61.36 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.551 -174.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 57.5 m-20 -95.07 -3.32 48.41 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.702 1.001 . . . . 0.0 113.702 -175.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 10.9 m 54.72 43.53 29.97 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 121.516 0.674 . . . . 0.0 110.748 176.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 32.6 m -126.99 145.21 50.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.511 -178.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 13.6 p -90.75 130.91 36.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.25 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -119.41 122.32 41.5 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 175.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 34.6 t -125.4 145.14 33.26 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-O 120.614 0.245 . . . . 0.0 110.623 -177.202 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -148.68 126.39 5.73 Favored Pre-proline 0 CA--C 1.538 0.501 0 CA-C-O 118.747 -0.644 . . . . 0.0 110.498 174.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -75.27 150.91 37.69 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 121.621 1.547 . . . . 0.0 111.891 175.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 66.4 mt -93.68 120.35 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.156 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.416 179.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 68.3 p -99.33 154.25 18.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.785 175.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -93.7 26.49 16.01 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.721 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.5 t -111.04 -12.86 14.16 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.411 0.522 . . . . 0.0 112.411 174.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 78.0 mt -67.52 146.14 54.23 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.072 0.463 . . . . 0.0 111.262 -176.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.1 tt0 -117.62 135.85 53.7 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.801 176.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 63.0 mt -112.18 155.56 23.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.923 0.392 . . . . 0.0 110.8 -177.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -147.55 144.16 28.31 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.079 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.0 t -99.48 109.09 21.68 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.668 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -106.77 103.78 48.5 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 171.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.18 143.52 44.31 Favored 'Trans proline' 0 N--CA 1.496 1.671 0 CA-C-N 120.527 1.224 . . . . 0.0 112.329 -169.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -90.4 14.93 48.91 Favored 'Cis proline' 0 N--CA 1.499 1.842 0 CA-C-N 121.05 1.411 . . . . 0.0 113.481 -4.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -95.46 170.67 9.2 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 122.419 0.288 . . . . 0.0 110.776 -177.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 52.4 tp -116.32 133.47 55.99 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 174.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 11.1 tp -125.09 140.51 52.82 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.392 -173.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 48.0 p90 -142.97 150.08 39.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.943 0.402 . . . . 0.0 110.523 175.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 26.5 mtm180 -102.37 146.9 27.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.26 -175.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -128.46 157.17 41.85 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.901 0.857 . . . . 0.0 111.367 -179.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 54.6 tt0 -49.57 150.05 2.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.724 -177.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 64.56 30.95 12.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.241 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 42.1 t 68.88 35.27 2.97 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.005 0.431 . . . . 0.0 111.645 164.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -98.96 140.61 32.85 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 177.531 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 78.9 mt -114.75 124.05 71.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -177.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -135.14 146.1 48.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.423 -178.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -144.33 169.35 26.4 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 120.888 -0.673 . . . . 0.0 111.648 -177.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -126.16 142.81 51.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.027 0.441 . . . . 0.0 110.752 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 73.7 t90 -106.31 125.01 50.47 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.443 174.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -111.29 139.69 46.48 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 123.281 0.363 . . . . 0.0 110.611 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -51.74 -37.53 51.46 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.678 179.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -132.54 136.06 46.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.42 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 84.5 p -62.8 -41.62 99.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.303 -177.507 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -59.85 -44.02 94.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.509 0.671 . . . . 0.0 110.016 178.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -56.51 -44.67 80.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.067 178.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 50.2 t -59.2 -39.72 83.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.519 177.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -58.89 -45.94 89.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.852 0.358 . . . . 0.0 110.642 -177.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 22.8 ttp-105 -61.33 -50.16 74.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.791 -177.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 30.2 mm -58.56 -44.16 88.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.051 0.453 . . . . 0.0 110.0 -178.19 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 59.7 p -59.85 -43.99 94.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.698 -177.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.56 -43.75 94.08 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 -178.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 12.0 mt -58.97 -48.5 81.31 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.05 0.453 . . . . 0.0 110.598 -178.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 54.5 t -59.07 -44.3 91.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.067 -178.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -57.39 -42.14 81.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.63 -178.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.9 -45.25 96.56 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -179.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 62.1 mt -58.65 -42.19 87.81 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.926 0.393 . . . . 0.0 110.642 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 88.0 mt -58.89 -40.46 84.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.867 -178.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 26.7 pttt -90.78 -8.13 50.53 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -179.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 29.9 t -113.99 142.72 45.81 Favored 'General case' 0 C--O 1.231 0.115 0 O-C-N 122.144 -0.348 . . . . 0.0 110.496 -179.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 97.5 mttt . . . . . 0 C--O 1.221 -0.423 0 CA-C-O 117.893 -1.051 . . . . 0.0 110.556 179.946 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.323 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -68.64 144.21 59.34 Favored 'Trans proline' 0 N--CA 1.495 1.565 0 C-N-CA 121.356 1.371 . . . . 0.0 111.892 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -97.89 122.28 40.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.533 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -72.93 153.78 90.98 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.492 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -52.08 150.93 17.69 Favored 'Trans proline' 0 N--CA 1.495 1.582 0 C-N-CA 121.272 1.315 . . . . 0.0 111.951 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.11 -45.33 73.99 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.061 -178.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 25.7 tp -138.14 131.47 30.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.774 0.321 . . . . 0.0 110.906 -178.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -135.98 128.54 30.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.523 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -98.99 -67.13 0.86 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.582 179.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -138.3 146.97 43.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.498 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 61.1 ttm-85 -102.46 119.23 38.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.512 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.56 161.53 23.21 Favored Pre-proline 0 CA--C 1.531 0.235 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.517 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -65.31 143.47 77.05 Favored 'Trans proline' 0 N--CA 1.496 1.619 0 C-N-CA 121.243 1.295 . . . . 0.0 111.793 179.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -113.9 99.85 51.12 Favored Pre-proline 0 CA--C 1.533 0.289 0 CA-C-O 119.216 -0.421 . . . . 0.0 110.516 -179.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -57.9 128.98 31.06 Favored 'Trans proline' 0 N--CA 1.496 1.623 0 C-N-CA 121.112 1.208 . . . . 0.0 111.538 177.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 101.14 -5.06 55.7 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 121.263 -0.494 . . . . 0.0 113.374 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -54.44 145.89 17.27 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 118.278 1.039 . . . . 0.0 110.914 178.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 11.3 ttp -61.27 143.66 92.47 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.158 -178.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -63.4 154.01 70.96 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 121.241 1.294 . . . . 0.0 111.522 175.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 37.0 t30 -99.21 99.88 10.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.451 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 19.9 mt -67.35 134.96 93.18 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 118.493 -0.765 . . . . 0.0 109.613 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -79.15 139.63 15.13 Favored 'Trans proline' 0 N--CA 1.493 1.455 0 CA-C-N 120.394 1.176 . . . . 0.0 111.193 174.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 6.7 mtmp? -97.28 125.99 43.51 Favored Pre-proline 0 CA--C 1.535 0.403 0 CA-C-O 118.343 -0.837 . . . . 0.0 110.119 178.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -61.86 165.34 14.3 Favored 'Trans proline' 0 N--CA 1.497 1.722 0 CA-C-N 120.657 1.27 . . . . 0.0 111.655 177.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -49.27 156.98 2.2 Favored 'Trans proline' 0 N--CA 1.497 1.679 0 C-N-CA 121.395 1.397 . . . . 0.0 111.866 178.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 6.2 mp -50.17 -29.19 8.74 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -176.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -56.4 -35.79 68.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.733 0.301 . . . . 0.0 111.429 -176.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 54.9 t90 -60.77 -48.14 83.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.955 0.407 . . . . 0.0 110.465 -176.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -65.23 -48.11 74.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.921 0.391 . . . . 0.0 110.804 -178.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -57.81 -44.39 86.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.964 0.412 . . . . 0.0 110.758 -176.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -59.19 -47.9 83.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.398 -177.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -57.82 -45.27 86.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.684 -177.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -61.23 -46.14 91.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.319 -176.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 60.7 tttm -61.84 -47.71 83.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.138 -175.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 -64.29 -48.97 73.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.804 -176.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -90.94 15.12 12.03 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 -176.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -143.03 150.9 40.21 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-O 120.874 0.369 . . . . 0.0 110.678 178.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 27.8 tp . . . . . 0 C--O 1.221 -0.421 0 CA-C-O 118.07 -0.967 . . . . 0.0 110.57 -179.863 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.306 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -69.54 130.11 19.03 Favored 'Trans proline' 0 N--CA 1.496 1.633 0 CA-C-N 118.841 1.32 . . . . 0.0 112.01 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -110.67 -40.44 4.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.766 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 95.3 mmm -56.41 -38.1 71.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.919 -179.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -56.7 139.91 48.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.76 0.314 . . . . 0.0 110.704 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -84.62 125.86 32.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.612 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 6.3 mp -57.74 -40.53 79.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.714 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.2 mtt -92.5 133.23 36.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.473 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.53 137.42 50.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.634 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 77.1 m-20 -74.34 157.67 35.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.61 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -60.1 -37.07 78.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.004 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.2 p -57.46 -41.54 80.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.976 0.417 . . . . 0.0 110.427 -179.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.2 mm -60.18 -44.44 95.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.198 -179.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.4 m -59.05 -44.71 91.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.991 0.424 . . . . 0.0 110.534 -177.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -59.36 -47.12 86.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.4 -178.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 87.2 mtp -58.29 -42.49 86.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.127 0.489 . . . . 0.0 110.41 -178.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -59.88 -48.5 81.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.298 -178.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.7 tp -60.4 -33.43 72.47 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.127 -178.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.5 -50.03 73.03 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.65 0.262 . . . . 0.0 110.688 179.041 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.11 -41.18 87.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.952 0.406 . . . . 0.0 110.565 179.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 96.8 mt -54.19 -52.88 33.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.618 178.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -53.61 -24.06 12.86 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -177.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.7 mtpt -60.25 -33.07 71.79 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -177.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 45.8 mm -109.12 -41.25 4.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.802 0.334 . . . . 0.0 110.407 -176.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -116.27 77.82 7.66 Favored Pre-proline 0 CA--C 1.535 0.392 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.311 -177.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -53.72 -20.46 17.06 Favored 'Trans proline' 0 N--CA 1.498 1.784 0 C-N-CA 121.469 1.446 . . . . 0.0 113.427 -176.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.2 p90 -94.42 17.63 12.66 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -174.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -92.45 127.5 37.96 Favored 'General case' 0 C--O 1.232 0.133 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 173.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 79.2 tttt -101.57 -40.61 6.94 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.75 -176.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -150.59 156.37 41.25 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.976 0.417 . . . . 0.0 111.336 -179.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 58.1 mt -93.09 136.5 24.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.174 177.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.1 t -88.44 -47.1 15.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.753 176.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -152.34 157.01 40.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.865 177.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.4 p -143.29 131.98 22.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.988 0.423 . . . . 0.0 111.056 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.6 t -109.13 126.17 52.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.706 177.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.2 t -54.47 -39.08 67.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.243 -171.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -150.21 127.04 11.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.242 0.544 . . . . 0.0 111.722 -178.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 94.6 t -145.14 140.5 22.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.437 -177.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.46 149.81 51.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.14 -177.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -97.91 132.08 43.81 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.249 0.547 . . . . 0.0 111.588 -176.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -125.61 142.31 51.57 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.759 179.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 80.4 m -120.81 148.14 44.41 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.184 -0.672 . . . . 0.0 109.184 177.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -109.48 131.97 54.56 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.975 0.417 . . . . 0.0 110.483 176.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -104.25 116.15 31.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.969 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 85.1 p -69.85 -31.03 68.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.137 -176.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -61.9 -38.1 87.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.662 0.267 . . . . 0.0 110.914 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -95.49 -21.42 18.32 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -178.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 28.3 t30 69.16 43.67 1.07 Allowed 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.366 0.603 . . . . 0.0 109.739 -177.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -151.07 164.52 36.27 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.99 -177.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 85.0 m95 -96.01 141.55 29.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.468 178.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -123.88 127.46 48.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.945 177.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.9 ttpp -75.1 139.96 43.12 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 62.3 p -92.34 173.35 7.85 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.088 -179.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -84.83 12.6 7.07 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 178.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.7 t -104.28 106.48 20.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 121.0 0.428 . . . . 0.0 110.311 179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -130.47 115.03 16.26 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 176.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.63 176.51 38.95 Favored Glycine 0 CA--C 1.52 0.367 0 C-N-CA 120.08 -1.057 . . . . 0.0 112.182 -169.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -81.36 136.51 35.74 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 175.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -99.15 129.91 45.43 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.085 -176.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -133.46 143.13 48.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.287 177.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 69.9 mt -101.65 128.14 54.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 172.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -108.42 134.39 51.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.836 0.351 . . . . 0.0 111.136 -174.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 59.6 t60 -119.68 140.09 51.2 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.19 176.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.3 tpt180 -142.15 149.84 40.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.709 177.056 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -86.85 28.12 0.93 Allowed 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.79 170.19 22.93 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -64.13 125.98 89.26 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-O 118.46 -0.781 . . . . 0.0 110.005 -178.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.65 140.93 65.37 Favored 'Cis proline' 0 N--CA 1.497 1.682 0 CA-C-N 121.844 1.694 . . . . 0.0 111.833 -1.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -65.7 -47.71 74.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.059 -177.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -142.15 135.38 28.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.458 0.647 . . . . 0.0 110.926 -176.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.0 t -150.93 152.36 33.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.413 -177.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.2 mt -107.93 140.13 27.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -131.73 142.0 49.67 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.625 -177.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.0 mt -127.89 130.9 70.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.238 0.542 . . . . 0.0 110.053 173.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -99.21 99.61 10.61 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.753 -179.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -71.69 105.07 3.56 Favored 'General case' 0 C--N 1.332 -0.183 0 O-C-N 123.757 0.661 . . . . 0.0 110.672 -177.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -72.52 -42.05 65.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.5 -170.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.8 mt -71.95 -45.27 61.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.702 -174.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 54.7 m-20 -95.02 -3.35 48.52 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -175.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.9 m 54.94 43.6 29.65 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.399 0.619 . . . . 0.0 110.648 177.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.7 m -125.35 141.59 51.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.531 -178.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 14.8 p -88.15 130.18 35.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.291 -179.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -118.85 122.29 42.0 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 175.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 30.3 t -125.5 145.75 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 120.678 0.275 . . . . 0.0 110.532 -177.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -149.14 126.36 5.52 Favored Pre-proline 0 CA--C 1.538 0.488 0 CA-C-O 118.698 -0.667 . . . . 0.0 110.561 174.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -75.41 150.95 37.12 Favored 'Trans proline' 0 N--CA 1.498 1.757 0 C-N-CA 121.463 1.442 . . . . 0.0 112.305 177.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 69.2 mt -92.65 133.93 32.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 CA-C-O 120.977 0.418 . . . . 0.0 110.249 178.122 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.0 p -132.14 158.48 41.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.775 177.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -94.68 35.03 4.4 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.026 -178.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.7 t -108.47 -23.31 11.92 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 173.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.5 mt -68.36 148.58 50.5 Favored 'General case' 0 C--O 1.23 0.077 0 CA-C-O 120.922 0.391 . . . . 0.0 111.324 -176.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.5 tt0 -118.16 135.84 53.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.784 176.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.4 mt -113.9 157.93 21.74 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.075 0.464 . . . . 0.0 111.0 -176.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -148.14 139.54 23.56 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.2 t -97.33 109.17 21.98 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.793 -179.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -106.71 103.74 48.16 Favored Pre-proline 0 C--N 1.329 -0.321 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 172.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -71.18 139.61 35.74 Favored 'Trans proline' 0 N--CA 1.496 1.676 0 CA-C-N 120.619 1.257 . . . . 0.0 112.002 -171.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -89.11 9.0 65.74 Favored 'Cis proline' 0 N--CA 1.501 1.943 0 CA-C-N 121.213 1.469 . . . . 0.0 113.764 -4.282 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -84.62 170.11 13.69 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.7 0.286 . . . . 0.0 111.223 -177.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 53.7 tp -118.66 131.75 56.17 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 170.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 11.6 tp -123.63 139.56 53.87 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 110.408 -0.219 . . . . 0.0 110.408 -174.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 11.7 p90 -144.49 151.3 38.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.938 0.399 . . . . 0.0 110.651 176.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.4 mtm180 -102.13 148.93 24.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.023 -176.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -130.91 165.65 22.63 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.841 0.829 . . . . 0.0 111.666 -178.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -48.39 148.17 2.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.092 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 71.9 mtt85 63.17 30.86 15.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.212 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 52.1 m 66.55 35.18 5.57 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.921 0.391 . . . . 0.0 111.598 166.108 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -98.16 149.45 22.52 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 178.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 82.4 mt -117.89 127.84 75.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 121.064 0.459 . . . . 0.0 109.824 -177.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -135.99 150.38 49.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.382 177.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -142.25 169.36 25.43 Favored Glycine 0 CA--C 1.522 0.53 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 -176.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -125.38 139.45 53.66 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.847 0.356 . . . . 0.0 110.622 -179.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 7.4 t90 -107.75 127.55 53.78 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.57 175.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -116.14 144.2 44.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.832 0.349 . . . . 0.0 110.682 -179.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -51.57 -37.49 49.98 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.626 178.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -134.06 135.92 43.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.846 0.355 . . . . 0.0 110.531 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.8 m -61.33 -42.01 97.98 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.098 -177.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -59.46 -43.5 93.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.401 0.62 . . . . 0.0 110.081 178.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -56.31 -44.84 80.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.084 178.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 42.9 t -59.94 -39.85 86.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.708 178.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -59.28 -45.31 91.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.771 0.319 . . . . 0.0 110.608 -177.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -60.08 -49.13 78.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.518 -177.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 35.3 mm -58.43 -45.49 89.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.047 0.451 . . . . 0.0 110.094 -178.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 68.3 p -59.72 -43.34 94.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.756 -177.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.74 -44.36 94.17 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 110.66 -0.976 . . . . 0.0 110.66 -179.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 10.8 mt -58.77 -48.29 81.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.081 0.467 . . . . 0.0 110.503 -178.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 52.0 t -58.91 -43.78 89.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.171 -178.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -57.46 -42.41 82.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.635 -178.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.32 -43.16 99.47 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 78.2 mt -61.79 -41.37 97.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.833 0.349 . . . . 0.0 111.044 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 27.6 mt -65.87 -44.82 84.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.682 -177.263 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 26.7 pttt -72.7 -35.35 67.59 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.77 -175.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 29.1 t -106.11 134.98 48.38 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.837 0.351 . . . . 0.0 110.743 -178.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt . . . . . 0 C--O 1.221 -0.442 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.538 179.85 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.316 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -50.04 137.0 37.22 Favored 'Trans proline' 0 N--CA 1.495 1.587 0 CA-C-N 118.85 1.325 . . . . 0.0 112.088 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -104.6 126.15 51.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.518 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -71.02 154.54 94.13 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.538 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -49.02 108.98 0.22 Allowed 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 121.31 1.34 . . . . 0.0 112.034 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 29.3 tp -62.89 -39.3 94.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.944 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 6.8 mp -85.18 123.45 30.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.909 0.385 . . . . 0.0 110.642 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -143.5 157.68 44.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.455 179.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.87 -40.92 85.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.676 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -136.32 129.08 30.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.389 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 83.0 mtm180 -74.65 123.38 24.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.566 -179.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.61 155.24 40.89 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.554 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -77.5 153.76 30.9 Favored 'Trans proline' 0 N--CA 1.492 1.394 0 C-N-CA 121.464 1.443 . . . . 0.0 111.994 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -55.38 -61.64 5.74 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.191 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -63.66 128.93 23.46 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 120.935 1.09 . . . . 0.0 111.661 -176.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 96.25 -4.97 65.17 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 121.146 -0.549 . . . . 0.0 113.404 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -56.37 132.59 51.47 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-N 118.209 1.005 . . . . 0.0 110.618 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 6.4 ttt -92.94 140.46 23.47 Favored Pre-proline 0 CA--C 1.534 0.349 0 CA-C-O 118.907 -0.568 . . . . 0.0 109.974 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -74.62 147.04 35.16 Favored 'Trans proline' 0 N--CA 1.495 1.577 0 C-N-CA 121.219 1.279 . . . . 0.0 111.652 176.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 5.3 p30 -96.88 104.42 16.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.826 -178.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 10.8 mt -65.96 150.37 96.63 Favored Pre-proline 0 C--N 1.33 -0.275 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 177.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -79.14 139.73 15.2 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 C-N-CA 121.101 1.201 . . . . 0.0 111.241 175.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -97.3 125.96 43.59 Favored Pre-proline 0 CA--C 1.537 0.448 0 CA-C-O 118.474 -0.774 . . . . 0.0 109.915 178.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -78.17 169.05 20.91 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 121.272 1.315 . . . . 0.0 111.792 176.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -62.0 156.59 48.56 Favored 'Trans proline' 0 N--CA 1.495 1.616 0 C-N-CA 121.261 1.308 . . . . 0.0 111.41 177.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.9 tp -50.04 -28.55 7.22 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.451 0.538 . . . . 0.0 112.451 -176.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 67.9 t80 -54.84 -37.31 66.02 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.773 0.32 . . . . 0.0 111.304 -176.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 46.1 t90 -61.61 -48.07 82.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.411 -176.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -61.88 -48.98 78.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.025 0.441 . . . . 0.0 110.41 -177.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -58.92 -45.13 91.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.879 -176.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -59.28 -47.03 86.89 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.651 -176.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.23 -47.21 86.95 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.779 -177.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -61.1 -47.2 87.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.522 -173.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 31.1 pttt -70.94 -41.27 71.37 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.884 -175.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -60.52 -47.73 84.88 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 121.057 -0.257 . . . . 0.0 111.245 -178.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -65.0 -37.05 86.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.214 -179.265 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -153.25 151.57 30.2 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.911 0.386 . . . . 0.0 110.593 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 27.6 tp . . . . . 0 C--O 1.22 -0.464 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.518 179.853 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.345 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -67.98 139.46 47.15 Favored 'Trans proline' 0 N--CA 1.496 1.627 0 C-N-CA 121.325 1.35 . . . . 0.0 111.945 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -56.87 -40.57 76.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.798 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 65.6 mtt -98.01 166.91 11.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.633 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -139.76 166.81 23.63 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.538 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -57.53 145.75 32.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.548 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 29.4 tp -56.94 -40.83 77.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.692 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.7 mtt -99.03 129.96 45.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.515 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -178.09 102.91 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.58 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.9 p-10 -125.81 73.97 1.38 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.365 0.602 . . . . 0.0 110.593 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -67.32 -36.42 81.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.318 -178.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 85.8 p -57.37 -42.03 81.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.988 0.423 . . . . 0.0 110.558 -177.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.9 mm -60.43 -44.47 96.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.193 -178.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 35.2 m -59.41 -45.54 91.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.931 0.396 . . . . 0.0 110.499 -177.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -59.77 -45.42 92.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.553 -178.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 44.7 ttm -58.27 -43.04 87.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.049 0.452 . . . . 0.0 110.382 -178.34 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -60.5 -49.62 76.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.348 -178.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 13.7 tp -61.52 -30.67 70.78 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.412 -178.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.12 -50.12 71.75 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.621 0.248 . . . . 0.0 110.527 178.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.86 -41.05 86.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.976 0.417 . . . . 0.0 110.565 178.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 95.7 mt -54.21 -52.98 32.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.643 178.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 76.7 mttt -55.08 -26.8 40.32 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -177.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -61.98 -29.92 70.58 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 -177.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.7 mm -109.76 -40.49 4.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.699 0.285 . . . . 0.0 110.391 -176.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -115.37 83.23 10.28 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.241 -178.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -54.22 -21.39 22.39 Favored 'Trans proline' 0 N--CA 1.498 1.751 0 C-N-CA 121.444 1.429 . . . . 0.0 113.549 -175.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 34.7 p90 -97.29 20.52 11.38 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -175.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -102.89 130.87 50.07 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 173.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 55.5 tttm -119.74 -35.19 3.57 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.625 0.25 . . . . 0.0 111.571 -175.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 85.4 tt0 -128.94 144.6 51.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.852 0.358 . . . . 0.0 110.585 -177.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 58.3 mt -99.04 131.02 47.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.803 173.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.3 t -90.42 -47.19 14.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.375 -0.375 . . . . 0.0 109.992 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -156.95 157.08 34.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.951 178.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.9 p -142.71 132.0 23.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.224 0.535 . . . . 0.0 111.293 -179.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.4 t -105.41 123.73 48.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.526 176.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 88.1 p -53.97 -37.16 63.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.455 -172.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -151.1 126.27 9.91 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.128 0.49 . . . . 0.0 111.449 -179.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 99.0 t -145.2 136.53 20.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.671 -177.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -127.47 149.85 49.92 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.966 -178.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -99.26 132.03 44.87 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-O 121.29 0.567 . . . . 0.0 111.931 -176.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -126.21 141.62 51.85 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.348 178.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.5 m -122.06 145.0 48.57 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 177.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -108.3 131.94 54.21 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.929 0.395 . . . . 0.0 110.451 176.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -102.99 114.34 28.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.858 176.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.4 m -67.86 -32.37 72.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.026 -177.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -62.32 -37.49 85.78 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.665 0.269 . . . . 0.0 111.129 -177.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -95.09 -21.48 18.52 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 32.0 t30 69.17 46.03 0.83 Allowed 'General case' 0 C--O 1.231 0.11 0 CA-C-O 121.505 0.669 . . . . 0.0 109.441 -177.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 72.7 tt0 -155.43 152.72 29.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.865 -177.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -89.34 143.76 26.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.387 177.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -124.35 128.53 49.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.832 176.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 26.4 pttm -75.45 140.16 42.71 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.031 178.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 52.5 p -92.3 170.21 9.97 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.111 -178.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -83.83 12.58 5.85 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 177.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.7 t -104.07 106.49 20.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.067 0.46 . . . . 0.0 110.281 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -132.38 115.79 16.03 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 176.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.41 38.97 Favored Glycine 0 CA--C 1.519 0.341 0 C-N-CA 120.153 -1.022 . . . . 0.0 112.5 -169.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -81.42 133.42 35.41 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 174.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -98.46 128.03 44.65 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -175.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -132.43 142.66 49.35 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.353 177.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 69.6 mt -101.64 127.94 54.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 171.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 15.6 m-30 -108.47 135.55 49.56 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.812 0.339 . . . . 0.0 111.242 -176.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 37.1 t60 -114.9 143.26 45.42 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.935 173.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.5 tpt85 -142.1 148.94 39.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.456 . . . . 0.0 109.986 176.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -86.87 28.11 0.93 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.29 159.27 37.38 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -63.88 134.46 95.92 Favored Pre-proline 0 CA--C 1.537 0.475 0 CA-C-O 118.651 -0.69 . . . . 0.0 110.141 -175.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -67.43 140.81 54.57 Favored 'Cis proline' 0 N--CA 1.498 1.779 0 CA-C-N 121.603 1.608 . . . . 0.0 111.371 -3.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -68.54 -47.83 65.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.154 -177.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 76.8 m80 -142.57 135.61 28.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.322 0.582 . . . . 0.0 110.84 -177.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 5.2 t -149.82 152.2 34.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.35 -176.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 56.4 mt -110.45 139.51 33.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.596 -179.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -131.75 142.12 49.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.723 -176.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.5 mt -123.15 127.1 74.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.144 0.497 . . . . 0.0 109.783 172.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -93.13 99.54 12.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.505 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -73.4 105.52 4.81 Favored 'General case' 0 C--N 1.332 -0.189 0 O-C-N 123.818 0.699 . . . . 0.0 110.881 -175.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 69.3 mtm180 -73.04 -42.43 63.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.602 -170.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.5 mt -72.94 -45.08 60.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.63 -174.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -94.97 -3.38 48.6 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -175.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 72.0 p 50.8 43.58 28.2 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.429 0.633 . . . . 0.0 111.238 177.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 35.5 m -128.27 131.35 48.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.408 -179.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 77.1 p -74.43 130.02 38.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.429 -179.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -117.03 122.2 43.52 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 173.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 39.6 t -125.56 146.8 30.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 120.852 0.358 . . . . 0.0 110.802 -177.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -149.51 126.45 5.41 Favored Pre-proline 0 CA--C 1.538 0.485 0 CA-C-O 118.723 -0.656 . . . . 0.0 110.354 174.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -75.3 150.96 37.62 Favored 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 121.443 1.429 . . . . 0.0 112.033 177.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 65.2 mt -87.12 131.95 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.138 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.586 -179.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.7 p -132.16 157.98 42.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.599 176.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -108.83 38.91 3.1 Favored Glycine 0 CA--C 1.523 0.592 0 C-N-CA 121.115 -0.564 . . . . 0.0 111.856 -177.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 10.5 t -103.68 -30.07 10.67 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.767 -0.217 . . . . 0.0 111.156 172.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.23 149.0 44.97 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.828 0.347 . . . . 0.0 111.201 -176.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -106.52 141.71 37.37 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 175.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 66.9 mt -111.8 159.75 18.0 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.789 0.328 . . . . 0.0 110.504 -178.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -151.12 145.19 25.29 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 177.003 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 26.2 t -102.51 109.31 20.9 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.512 178.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -106.81 103.76 48.53 Favored Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 173.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -69.86 140.63 42.78 Favored 'Trans proline' 0 N--CA 1.497 1.7 0 CA-C-N 120.496 1.213 . . . . 0.0 112.074 -170.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -88.95 9.46 64.52 Favored 'Cis proline' 0 N--CA 1.5 1.905 0 CA-C-N 121.193 1.462 . . . . 0.0 113.697 -4.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -86.75 167.79 14.11 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.798 0.333 . . . . 0.0 111.109 -177.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 58.1 tp -115.75 133.97 55.49 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 170.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 12.4 tp -128.4 140.14 52.0 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.557 0.218 . . . . 0.0 110.469 -173.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 19.8 p90 -146.94 165.1 30.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.918 0.389 . . . . 0.0 110.592 176.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 37.8 mtt-85 -101.74 148.27 25.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.158 -178.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -128.83 163.94 24.12 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.867 0.841 . . . . 0.0 111.55 -177.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 32.0 mp0 -49.31 147.77 2.98 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.873 -176.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 79.6 mtm180 63.38 30.97 15.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.119 -0.946 . . . . 0.0 112.207 178.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 50.3 m 67.36 35.22 4.42 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.916 0.389 . . . . 0.0 111.535 167.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -101.49 152.71 20.44 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 179.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 77.1 mt -111.07 129.6 66.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -179.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -137.96 149.39 46.1 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.897 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.96 168.85 26.37 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 111.274 -0.73 . . . . 0.0 111.274 -177.275 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -125.29 138.61 54.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.815 0.341 . . . . 0.0 110.602 -179.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 7.6 t90 -104.12 122.61 45.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.536 175.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -112.51 143.02 44.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.771 0.319 . . . . 0.0 110.554 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 72.3 t80 -50.7 -35.87 33.29 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.702 178.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.9 t-20 -136.27 134.92 38.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.762 0.315 . . . . 0.0 110.462 179.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.6 t -61.68 -42.07 98.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.089 -177.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 -60.29 -43.54 96.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.375 0.607 . . . . 0.0 110.158 179.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 49.3 tt0 -56.62 -45.88 81.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.604 0.716 . . . . 0.0 110.0 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 38.4 t -60.56 -38.29 84.06 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.854 178.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -58.85 -46.22 88.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.923 0.392 . . . . 0.0 110.44 -177.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 51.2 mtp180 -58.98 -47.63 84.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.073 0.463 . . . . 0.0 110.552 -178.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 29.1 mm -58.23 -45.64 88.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.085 -179.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.0 p -59.29 -42.98 92.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.72 -177.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.6 -44.99 93.71 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.614 -0.995 . . . . 0.0 110.614 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 10.4 mt -58.67 -49.1 78.78 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.181 0.515 . . . . 0.0 110.491 -178.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 49.3 t -58.53 -41.42 81.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.265 -178.054 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -58.5 -43.76 89.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.89 0.376 . . . . 0.0 110.593 -179.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -60.75 -40.78 98.58 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.262 -0.735 . . . . 0.0 111.262 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.9 mt -65.69 -43.06 90.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.645 0.26 . . . . 0.0 111.414 179.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 18.1 mt -62.37 -44.93 95.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.258 -176.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 29.5 pttt -70.41 -37.62 74.49 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.124 -178.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 56.5 p -73.46 162.96 28.7 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.789 0.328 . . . . 0.0 110.444 179.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 22.9 pttm . . . . . 0 C--O 1.221 -0.44 0 CA-C-O 118.02 -0.991 . . . . 0.0 110.74 -179.92 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.266 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.84 137.92 34.61 Favored 'Trans proline' 0 N--CA 1.495 1.578 0 CA-C-N 118.836 1.318 . . . . 0.0 112.02 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -101.15 122.16 43.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.521 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -73.96 152.97 88.85 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.531 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -83.88 133.93 6.05 Favored 'Trans proline' 0 N--CA 1.491 1.368 0 C-N-CA 121.491 1.46 . . . . 0.0 112.249 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 79.0 mt -60.66 -41.62 95.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.429 179.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.3 mt -102.86 144.43 31.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.5 179.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -80.83 129.46 34.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.479 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -150.01 -66.94 0.21 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.542 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -102.07 152.46 20.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.573 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -112.48 141.59 46.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.435 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -102.33 159.87 28.06 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.511 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -69.59 146.53 61.52 Favored 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 121.326 1.351 . . . . 0.0 111.947 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -144.63 159.67 50.25 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.611 -179.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -57.92 128.95 30.92 Favored 'Trans proline' 0 N--CA 1.495 1.58 0 C-N-CA 121.195 1.263 . . . . 0.0 111.713 -178.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 100.76 -5.17 56.58 Favored Glycine 0 CA--C 1.534 1.234 0 CA-C-O 119.639 -0.534 . . . . 0.0 113.499 179.13 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -92.16 143.92 25.95 Favored 'General case' 0 C--O 1.231 0.083 0 CA-C-N 118.229 1.015 . . . . 0.0 110.535 177.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 6.5 ttt -66.61 118.17 51.55 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-O 118.555 -0.736 . . . . 0.0 110.273 -179.119 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -64.45 160.02 41.43 Favored 'Trans proline' 0 N--CA 1.499 1.795 0 CA-C-N 120.471 1.204 . . . . 0.0 111.663 177.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 63.0 t30 -95.39 111.13 23.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.85 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 8.3 mt -74.23 136.92 75.41 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 118.55 -0.738 . . . . 0.0 109.532 178.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -79.13 139.57 15.12 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 CA-C-N 120.211 1.111 . . . . 0.0 111.237 174.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -97.31 125.89 43.84 Favored Pre-proline 0 CA--C 1.536 0.436 0 CA-C-O 118.473 -0.775 . . . . 0.0 110.279 178.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -67.41 160.37 48.09 Favored 'Trans proline' 0 N--CA 1.497 1.712 0 C-N-CA 121.165 1.243 . . . . 0.0 111.627 175.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.82 156.86 2.94 Favored 'Trans proline' 0 N--CA 1.497 1.686 0 C-N-CA 121.288 1.326 . . . . 0.0 111.827 178.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.4 tp -50.04 -29.15 8.19 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -176.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 64.9 t80 -54.94 -38.27 67.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.932 0.396 . . . . 0.0 111.164 -177.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 35.7 t90 -60.6 -48.2 82.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.206 -177.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -61.48 -48.18 82.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.965 0.412 . . . . 0.0 110.67 -176.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -60.0 -46.11 90.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.819 -176.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -58.08 -46.31 85.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.693 -175.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -61.56 -51.36 68.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.904 -176.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -58.95 -40.07 83.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.343 -174.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 68.7 tttt -69.12 -52.47 27.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.494 -177.334 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -55.6 -49.11 73.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.442 -175.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -70.8 -36.99 73.25 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.256 -178.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -63.34 146.11 54.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.857 0.36 . . . . 0.0 110.63 -179.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 78.8 mt . . . . . 0 C--O 1.219 -0.524 0 CA-C-O 118.065 -0.969 . . . . 0.0 110.547 179.711 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.381 0 N-CA-C 110.614 -0.995 . . . . 0.0 110.614 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -66.02 130.65 24.88 Favored 'Trans proline' 0 N--CA 1.497 1.706 0 CA-C-N 119.285 1.543 . . . . 0.0 111.968 -175.853 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -58.63 -40.68 84.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.782 -179.92 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 72.1 mtm -90.6 161.58 15.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.644 -179.401 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -57.32 153.85 11.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.555 -179.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -58.46 141.75 50.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.54 -179.72 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 28.4 tp -57.05 -39.64 75.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.898 -179.884 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.5 ttm -84.85 120.0 25.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.733 -179.248 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -143.76 83.93 1.77 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.326 179.112 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -78.99 140.1 38.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.841 -178.428 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.4 mp0 -67.12 -30.56 70.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.59 178.394 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 24.7 m -55.27 -38.6 68.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.823 0.344 . . . . 0.0 110.857 -178.414 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.4 mm -59.52 -46.85 92.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.991 0.424 . . . . 0.0 110.041 -179.005 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.4 m -58.68 -44.38 90.21 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.15 0.5 . . . . 0.0 110.449 -178.339 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -59.2 -45.32 91.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.644 -178.571 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 89.6 mtp -58.29 -42.84 87.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.996 0.426 . . . . 0.0 110.463 -178.221 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -59.26 -49.44 77.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.027 0.441 . . . . 0.0 110.146 -178.925 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.1 tp -61.31 -30.36 70.45 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.36 -179.609 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.98 -49.91 72.85 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 122.224 -0.298 . . . . 0.0 110.579 177.862 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.94 -41.55 83.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.963 0.411 . . . . 0.0 110.464 178.422 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 92.6 mt -54.16 -53.03 32.1 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.748 179.23 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.6 mttp -53.8 -27.64 30.47 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -178.134 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -60.46 -32.2 71.18 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -176.503 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.3 mm -107.4 -41.08 5.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.864 0.364 . . . . 0.0 110.44 -176.031 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -115.13 83.36 9.83 Favored Pre-proline 0 CA--C 1.534 0.332 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.206 -178.691 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -53.65 -20.8 17.58 Favored 'Trans proline' 0 N--CA 1.498 1.759 0 C-N-CA 121.505 1.47 . . . . 0.0 113.422 -176.254 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -99.23 22.03 11.08 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.756 0.651 . . . . 0.0 112.756 -175.225 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -110.57 127.36 55.18 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 173.262 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.7 pttp -122.99 -24.54 4.74 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -175.788 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.3 tp10 -127.77 140.26 52.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.726 0.298 . . . . 0.0 110.594 -179.768 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 52.6 mt -98.1 132.17 43.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.341 -0.39 . . . . 0.0 109.998 174.239 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.1 t -92.87 -47.13 13.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.173 179.938 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -155.02 156.31 35.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.038 178.69 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.4 p -143.03 131.98 22.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.098 0.475 . . . . 0.0 111.125 179.683 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.3 t -107.22 125.91 51.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.663 177.39 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 87.3 p -54.33 -37.77 65.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.309 -172.255 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -151.84 126.62 9.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.146 0.498 . . . . 0.0 111.688 -178.997 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 99.2 t -145.26 140.17 22.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.474 -177.713 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.15 149.88 50.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.147 -178.067 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -97.89 133.62 42.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.187 0.518 . . . . 0.0 111.749 -176.383 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -126.56 142.0 51.68 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.467 178.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 82.0 m -120.47 146.77 45.92 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.818 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -108.48 131.94 54.31 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.988 0.423 . . . . 0.0 110.471 176.125 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 -104.37 115.98 31.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.962 177.51 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 87.9 p -69.06 -31.46 70.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.064 -176.816 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.2 t -60.9 -39.84 90.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.763 0.316 . . . . 0.0 110.876 -177.58 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -94.43 -21.38 18.96 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -178.703 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 69.79 43.62 0.93 Allowed 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.355 0.598 . . . . 0.0 109.748 -177.922 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -151.26 162.9 40.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.103 -177.77 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 88.0 m95 -94.76 142.53 27.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.373 177.639 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -124.34 126.69 46.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 0.0 109.905 175.527 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 38.8 tttp -73.95 139.81 45.13 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.394 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 67.2 p -92.4 171.89 8.75 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.153 -178.365 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -83.75 12.49 5.88 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 178.681 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.5 t -102.43 106.47 19.94 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-O 120.964 0.411 . . . . 0.0 110.291 179.719 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -131.1 114.89 15.7 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 176.717 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.61 176.52 38.93 Favored Glycine 0 CA--C 1.519 0.295 0 C-N-CA 120.054 -1.069 . . . . 0.0 112.411 -169.67 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -81.26 134.7 35.64 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 175.145 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -98.3 127.57 44.3 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.079 -176.473 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -131.84 142.27 49.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.276 177.654 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 68.5 mt -101.59 127.71 54.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 172.308 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 16.3 m-30 -108.47 136.86 47.38 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.838 0.352 . . . . 0.0 111.216 -175.922 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 68.2 t60 -114.68 141.64 47.55 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.34 175.295 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -142.31 146.93 35.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.835 176.459 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -86.77 28.09 0.92 Allowed 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.998 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.37 172.8 17.69 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.765 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -64.04 124.68 86.07 Favored Pre-proline 0 CA--C 1.539 0.535 0 CA-C-O 118.55 -0.738 . . . . 0.0 110.081 -178.129 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -79.11 140.98 60.46 Favored 'Cis proline' 0 N--CA 1.495 1.609 0 CA-C-N 121.79 1.675 . . . . 0.0 111.537 -1.677 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -63.73 -46.37 85.67 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.922 -177.613 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -142.37 136.22 29.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.274 0.559 . . . . 0.0 110.664 -177.46 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.3 t -150.26 151.33 32.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.454 -177.396 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 50.1 mt -110.86 139.51 34.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -179.228 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -131.83 142.06 49.61 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.81 -176.796 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 60.9 mt -123.82 127.31 73.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.214 0.531 . . . . 0.0 109.813 172.463 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 -94.25 99.54 11.76 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.011 -0.995 . . . . 0.0 109.445 -179.756 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.8 t-20 -74.48 105.75 5.76 Favored 'General case' 0 C--N 1.332 -0.165 0 O-C-N 123.728 0.642 . . . . 0.0 110.951 -175.474 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -71.84 -42.11 67.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.602 -170.879 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.8 mt -73.32 -45.17 56.88 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.781 -173.794 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 52.3 m-20 -95.07 -3.42 48.19 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -175.573 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.1 m 53.04 42.76 32.25 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.493 0.663 . . . . 0.0 111.039 177.095 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.1 m -128.49 132.68 48.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.585 -178.146 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 86.8 p -76.66 130.71 38.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.412 -179.296 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -118.0 122.26 42.74 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 172.965 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 31.4 t -125.55 146.39 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-O 120.745 0.307 . . . . 0.0 110.764 -176.399 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -147.88 126.37 6.09 Favored Pre-proline 0 CA--C 1.539 0.526 0 CA-C-O 118.633 -0.699 . . . . 0.0 110.43 173.836 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -75.47 150.91 36.83 Favored 'Trans proline' 0 N--CA 1.499 1.83 0 C-N-CA 121.453 1.435 . . . . 0.0 112.282 177.682 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 68.3 mt -93.21 134.64 30.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.229 177.715 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.1 p -132.14 158.06 42.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.702 177.401 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -94.27 34.96 4.4 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.059 -178.567 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.0 t -111.09 -21.15 12.1 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 173.79 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.9 mt -68.61 149.04 49.63 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-O 120.925 0.393 . . . . 0.0 111.379 -176.149 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -115.34 135.87 53.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.682 176.265 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 70.5 mt -114.81 155.21 27.19 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.913 0.387 . . . . 0.0 110.823 -176.963 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -148.7 142.77 25.93 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 178.317 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.6 t -103.52 109.19 20.75 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.645 -0.422 . . . . 0.0 110.919 -179.849 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -106.8 103.81 48.71 Favored Pre-proline 0 C--N 1.329 -0.318 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 171.333 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.09 141.91 49.36 Favored 'Trans proline' 0 N--CA 1.496 1.666 0 CA-C-N 120.477 1.206 . . . . 0.0 111.964 -172.126 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -89.86 11.66 58.31 Favored 'Cis proline' 0 N--CA 1.5 1.853 0 CA-C-N 121.108 1.431 . . . . 0.0 113.629 -3.613 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -90.41 168.25 12.01 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-O 120.62 0.248 . . . . 0.0 110.901 -178.365 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 54.6 tp -118.39 135.02 54.58 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 171.52 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.5 tp -126.97 139.15 53.26 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.539 0.209 . . . . 0.0 110.563 -174.487 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -143.13 148.63 36.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.986 0.422 . . . . 0.0 110.178 175.543 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 25.9 mtm180 -103.44 150.56 23.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.135 -175.854 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 24.1 m120 -129.98 162.69 28.09 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.812 0.815 . . . . 0.0 111.221 -179.769 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 51.6 tt0 -49.51 149.55 2.27 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.72 -177.014 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 64.76 30.88 12.17 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.351 -0.841 . . . . 0.0 112.116 -179.834 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 18.2 m 66.64 35.11 5.45 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.958 0.409 . . . . 0.0 111.605 165.652 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 46.9 mtp85 -98.99 143.29 29.45 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.988 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 75.9 mt -117.68 126.1 74.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-O 121.181 0.515 . . . . 0.0 110.055 -175.412 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 81.4 mmt-85 -130.95 147.35 52.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.444 178.788 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -139.66 166.42 25.6 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 -178.143 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -125.33 139.8 53.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.878 0.371 . . . . 0.0 110.516 -179.741 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 15.5 t90 -107.49 124.81 50.44 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.464 174.314 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -113.84 143.34 44.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.785 0.326 . . . . 0.0 110.667 -179.481 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -51.24 -35.96 39.47 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.618 178.232 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.5 t-20 -136.04 134.4 38.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.371 179.39 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.0 t -60.79 -41.42 95.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.012 -177.654 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -59.82 -43.21 94.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.315 0.578 . . . . 0.0 110.194 178.881 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -56.78 -45.32 82.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.511 0.672 . . . . 0.0 109.966 179.05 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 42.2 t -59.94 -39.04 84.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.711 178.351 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -59.31 -45.98 89.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.914 0.388 . . . . 0.0 110.577 -177.303 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 60.4 ttm-85 -59.36 -48.45 81.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.998 0.428 . . . . 0.0 110.523 -177.923 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 30.8 mm -58.23 -45.97 88.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.058 -178.709 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 60.3 p -59.28 -43.07 92.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.665 -177.37 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.79 -44.37 94.25 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.654 -0.978 . . . . 0.0 110.654 -178.879 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 10.8 mt -58.4 -49.39 77.43 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.162 0.506 . . . . 0.0 110.528 -178.428 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 52.6 t -59.12 -42.63 87.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.13 -178.597 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -57.68 -41.96 82.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.795 0.331 . . . . 0.0 110.594 -178.95 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -60.84 -45.79 95.8 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.954 -0.859 . . . . 0.0 110.954 -179.806 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 58.6 mt -58.68 -42.28 88.17 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.901 0.381 . . . . 0.0 110.548 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 59.1 mt -60.13 -41.68 93.18 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.796 -179.38 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 25.6 pttt -88.36 2.38 52.71 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.264 0.838 . . . . 0.0 113.264 -179.208 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 90.4 p -116.09 149.22 39.32 Favored 'General case' 0 N--CA 1.461 0.102 0 CA-C-N 118.138 0.426 . . . . 0.0 110.391 179.135 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.0 ttmp? . . . . . 0 C--O 1.22 -0.448 0 CA-C-O 117.923 -1.037 . . . . 0.0 110.542 -179.546 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -49.38 142.68 22.06 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 121.325 1.35 . . . . 0.0 112.045 179.976 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -99.53 124.88 45.11 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.521 179.97 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 36.4 t0 -83.18 126.21 72.68 Favored Pre-proline 0 CA--C 1.537 0.443 0 CA-C-O 118.491 -0.766 . . . . 0.0 109.921 -179.897 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -73.36 -30.09 10.58 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 121.143 1.229 . . . . 0.0 112.402 179.567 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 28.0 tp -56.21 -40.05 73.42 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.84 -179.554 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.6 mt -92.42 140.89 29.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.563 -179.99 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -99.52 135.8 40.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.534 179.875 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -60.49 -40.45 91.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.781 -179.923 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -130.21 125.16 34.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.476 179.915 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 49.3 ttt85 -113.15 149.09 34.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.391 179.922 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -56.37 153.81 18.52 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.742 -179.263 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -54.71 157.13 13.12 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 121.384 1.389 . . . . 0.0 112.108 -179.607 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -107.03 99.94 29.34 Favored Pre-proline 0 CA--C 1.532 0.272 0 CA-C-O 118.987 -0.53 . . . . 0.0 110.321 179.353 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -57.99 128.92 30.74 Favored 'Trans proline' 0 N--CA 1.497 1.714 0 C-N-CA 121.017 1.145 . . . . 0.0 111.471 -179.993 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 99.59 -5.04 58.35 Favored Glycine 0 CA--C 1.536 1.395 0 C-N-CA 121.25 -0.5 . . . . 0.0 113.364 -179.248 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -55.13 145.45 21.05 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 118.183 0.991 . . . . 0.0 110.858 178.953 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 7.7 ttp -61.15 143.51 92.29 Favored Pre-proline 0 CA--C 1.533 0.314 0 CA-C-O 119.067 -0.492 . . . . 0.0 110.058 -179.319 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -59.45 149.23 82.97 Favored 'Trans proline' 0 N--CA 1.497 1.69 0 C-N-CA 121.241 1.294 . . . . 0.0 111.721 177.671 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 26.2 m120 -106.28 113.85 27.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.729 -179.555 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 13.1 mt -80.34 153.8 74.15 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.255 -0.429 . . . . 0.0 109.941 178.193 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -79.01 139.75 15.44 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 121.172 1.248 . . . . 0.0 111.343 174.986 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -97.08 125.97 44.01 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-O 118.451 -0.785 . . . . 0.0 109.886 179.901 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -78.13 161.88 29.11 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 121.258 1.305 . . . . 0.0 111.868 176.177 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -50.86 150.01 13.54 Favored 'Trans proline' 0 N--CA 1.494 1.524 0 C-N-CA 121.293 1.329 . . . . 0.0 111.642 177.811 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 81.0 mt -49.91 -28.36 6.56 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -176.611 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 68.3 t80 -55.37 -38.39 68.76 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.859 0.361 . . . . 0.0 111.173 -176.923 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 9.2 t90 -60.6 -48.06 83.46 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.301 -176.57 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -64.0 -48.5 76.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.898 0.38 . . . . 0.0 110.863 -176.983 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.36 -45.47 91.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.87 -176.326 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -59.75 -47.33 86.1 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.612 -176.424 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.12 -46.93 87.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.032 0.444 . . . . 0.0 110.753 -177.436 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -60.23 -44.39 95.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.286 -176.284 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 96.3 mttt -63.22 -46.9 84.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.188 -177.06 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -58.34 -49.01 78.73 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.059 -178.193 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -90.18 15.06 10.99 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 179.464 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -167.4 123.05 1.08 Allowed 'General case' 0 C--O 1.231 0.13 0 CA-C-O 120.838 0.351 . . . . 0.0 110.585 179.362 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 79.8 mt . . . . . 0 C--O 1.221 -0.411 0 CA-C-O 117.911 -1.042 . . . . 0.0 110.405 179.714 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 90.7 p . . . . . 0 CA--C 1.527 0.067 0 CA-C-O 120.898 0.38 . . . . 1.49 110.725 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.4 mm -60.07 -46.3 94.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.279 -0.419 . . . . 0.54 110.182 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 36.2 m -58.85 -44.91 91.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.3 -0.409 . . . . 0.44 110.369 -177.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -59.22 -45.24 91.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.096 -0.502 . . . . 3.48 110.594 -178.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 96.9 mmm -58.2 -43.37 87.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.034 0.445 . . . . 1.56 110.417 -178.229 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.9 m120 -60.03 -49.46 77.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.156 -0.475 . . . . 1.04 110.202 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.747 ' HA ' HD12 ' A' ' 14' ' ' ILE . 14.4 tp -61.49 -30.07 70.38 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.593 -0.443 . . . . 0.26 111.368 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.05 -50.45 70.6 Favored 'General case' 0 C--N 1.333 -0.142 0 O-C-N 122.281 -0.262 . . . . 0.26 110.551 177.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.94 -42.01 84.01 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.078 0.466 . . . . 0.2 110.373 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.747 HD12 ' HA ' ' A' ' 11' ' ' LEU . 97.6 mt -54.05 -53.08 30.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.692 -0.685 . . . . 0.2 110.66 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 54.2 mttm -53.1 -26.46 16.51 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.551 0.574 . . . . 1.46 112.551 -178.646 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -59.49 -33.18 71.01 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 111.904 0.335 . . . . 3.34 111.904 -177.037 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 48.8 mm -104.48 -44.3 8.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.047 0.451 . . . . 0.32 110.089 -177.033 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -114.7 85.43 11.42 Favored Pre-proline 0 CA--C 1.534 0.338 0 CA-C-N 115.707 -0.679 . . . . 0.32 110.236 -176.433 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.07 -21.68 13.1 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 C-N-CA 121.399 1.399 . . . . 0.59 113.42 -176.381 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.0 p90 -100.01 17.2 21.62 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.347 0.869 . . . . 1.35 113.347 -174.463 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.408 ' HB3' HG22 ' A' ' 14' ' ' ILE . . . -94.31 118.97 32.38 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 109.09 -0.707 . . . . 0.35 109.09 173.122 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.488 ' O ' HD21 ' A' ' 11' ' ' LEU . 76.4 tttt -108.8 -37.78 5.79 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 120.835 -0.346 . . . . 2.95 111.513 -172.084 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -128.33 147.96 50.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.873 0.368 . . . . 1.78 110.979 -176.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.506 HG13 HD13 ' A' ' 11' ' ' LEU . 58.7 mt -102.98 131.77 50.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.009 -0.542 . . . . 0.25 109.926 173.697 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.8 t -92.1 -47.22 14.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.916 0.389 . . . . 0.16 110.031 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -155.9 156.17 34.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.028 -0.533 . . . . 0.13 110.059 178.088 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 59.7 p -142.5 132.0 23.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.936 0.398 . . . . 0.15 110.58 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.2 t -106.52 129.72 54.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.925 -0.579 . . . . 0.19 109.797 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 30.2 m -54.2 -38.7 65.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.715 -0.675 . . . . 1.31 111.251 -172.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -152.72 127.8 9.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.178 0.513 . . . . 0.3 111.598 -178.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.404 HG21 ' HB3' ' A' ' 52' ' ' PHE . 99.3 t -145.19 143.85 21.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.004 -0.998 . . . . 0.09 109.539 -177.797 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -131.15 149.82 52.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.562 -0.29 . . . . 0.13 111.094 -178.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -99.2 131.48 45.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.277 0.56 . . . . 1.47 111.507 -177.153 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -127.44 143.91 51.13 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 115.946 -0.57 . . . . 0.35 110.823 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 86.4 m -121.89 148.56 44.58 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.24 -0.652 . . . . 0.25 109.24 177.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -109.45 131.95 54.59 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.999 0.428 . . . . 1.11 110.441 176.416 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 -103.78 114.17 28.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.878 -0.601 . . . . 0.44 109.718 176.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 86.6 p -68.92 -30.3 68.73 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.903 -0.59 . . . . 1.36 112.196 -176.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.8 p -62.4 -39.17 92.37 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.686 0.279 . . . . 1.47 110.932 -177.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -94.5 -21.51 18.84 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.607 0.595 . . . . 2.0 112.607 -179.214 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 69.82 44.49 0.84 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 121.414 0.626 . . . . 1.3 109.652 -177.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -149.87 160.87 43.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.614 -0.721 . . . . 1.93 111.09 -177.444 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 80.7 m95 -94.66 140.76 29.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.085 -0.507 . . . . 0.3 110.379 177.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -122.87 129.08 51.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.274 -0.421 . . . . 2.3 110.039 177.082 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 72.9 tttt -76.84 140.39 40.63 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.948 -0.39 . . . . 2.6 109.948 178.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.1 p -92.34 176.0 6.64 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.723 -0.391 . . . . 0.32 110.131 -179.549 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -86.17 12.94 8.66 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.638 0.607 . . . . 2.17 112.638 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.8 t -106.94 106.42 20.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-O 120.916 0.389 . . . . 0.33 110.381 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -130.39 113.02 13.82 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.575 -0.898 . . . . 0.29 108.575 174.338 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.66 176.48 38.97 Favored Glycine 0 CA--C 1.52 0.376 0 C-N-CA 120.191 -1.004 . . . . 0.1 112.361 -168.651 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.461 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -79.37 136.15 36.91 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.9 -0.778 . . . . 0.09 108.9 174.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.404 ' HB3' HG21 ' A' ' 31' ' ' VAL . 4.9 t80 -101.94 127.23 48.87 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.96 -0.296 . . . . 0.1 110.388 -175.063 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.461 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 6.3 m-85 -130.61 142.19 50.45 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.785 0.326 . . . . 0.11 110.647 177.379 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.657 HD11 HG23 ' A' ' 116' ' ' ILE . 68.1 mt -101.55 127.1 55.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.241 -0.652 . . . . 0.16 109.241 171.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.688 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 13.8 m-30 -108.58 138.17 45.32 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.015 0.436 . . . . 0.21 111.285 -177.137 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 68.2 t60 -111.5 143.38 42.45 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.359 -0.837 . . . . 0.26 110.213 175.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -139.51 147.11 40.81 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.873 -0.603 . . . . 2.62 110.002 178.043 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -86.92 28.13 0.93 Allowed 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.15 -0.477 . . . . 1.26 112.136 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.52 160.79 38.57 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.735 -0.468 . . . . 0.36 109.735 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -63.98 131.16 94.87 Favored Pre-proline 0 CA--C 1.54 0.581 0 CA-C-O 118.483 -0.77 . . . . 2.53 110.059 -176.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -71.79 140.86 67.96 Favored 'Cis proline' 0 N--CA 1.498 1.752 0 CA-C-N 121.734 1.655 . . . . 0.63 111.58 -1.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -63.95 -40.43 96.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.278 -0.419 . . . . 1.34 111.079 -177.49 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.472 ' HB3' HD12 ' A' ' 80' ' ' ILE . 77.7 m80 -142.65 141.35 31.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.589 0.709 . . . . 0.3 111.044 -176.587 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.3 t -149.19 151.55 34.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.595 -0.729 . . . . 0.19 110.02 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.419 HG13 HD11 ' A' ' 80' ' ' ILE . 57.0 mt -115.62 138.98 44.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.43 . . . . 0.2 109.883 -177.024 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -131.85 142.14 49.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.787 -0.642 . . . . 1.27 111.1 -177.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.4 mt -120.33 128.99 76.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-O 121.235 0.54 . . . . 0.16 109.578 171.109 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -94.73 99.5 11.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.022 -0.99 . . . . 0.11 109.191 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.3 t-20 -72.53 105.84 4.36 Favored 'General case' 0 C--N 1.333 -0.138 0 O-C-N 123.65 0.594 . . . . 0.19 111.031 -174.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -73.87 -40.96 62.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.836 -0.62 . . . . 3.41 111.252 -171.058 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 70.9 mt -70.81 -45.23 64.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.359 -0.382 . . . . 0.29 111.644 -175.188 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 62.3 m-20 -95.06 -3.33 48.41 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 113.761 1.023 . . . . 1.89 113.761 -175.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.438 HG22 ' O ' ' A' ' 73' ' ' THR . 14.5 m 55.88 43.41 27.57 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-O 121.521 0.677 . . . . 1.18 110.49 177.537 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 34.5 m -127.45 148.87 50.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.441 -0.799 . . . . 0.39 110.618 -178.016 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.1 p -100.82 131.95 46.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.09 -0.505 . . . . 0.61 110.88 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -128.57 122.18 30.44 Favored 'General case' 0 N--CA 1.462 0.175 0 N-CA-C 110.204 -0.295 . . . . 1.38 110.204 175.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 p -125.57 149.95 30.59 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 116.358 -0.383 . . . . 1.25 111.004 -177.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -149.35 136.86 11.26 Favored Pre-proline 0 CA--C 1.538 0.488 0 CA-C-O 119.053 -0.499 . . . . 1.81 110.755 174.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.39 150.91 37.19 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 121.691 1.594 . . . . 0.28 112.378 178.347 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.472 HD12 ' HB3' ' A' ' 63' ' ' HIS . 64.4 mt -89.39 123.76 41.77 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 C-N-CA 120.657 -0.417 . . . . 0.25 110.47 178.452 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 40.4 p -99.35 159.02 15.31 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.073 -0.512 . . . . 0.55 110.065 175.511 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -98.41 7.75 61.94 Favored Glycine 0 CA--C 1.534 1.231 0 C-N-CA 120.97 -0.633 . . . . 0.5 113.597 -178.246 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.8 p -98.76 -5.31 31.56 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 117.947 0.873 . . . . 1.31 112.932 177.411 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.5 mt -68.99 141.18 54.98 Favored 'General case' 0 C--O 1.232 0.143 0 O-C-N 122.062 -0.398 . . . . 0.89 111.47 -177.249 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 57.2 tt0 -112.08 135.83 52.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.086 -0.507 . . . . 0.66 109.638 175.12 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.478 HD12 ' ND2' ' A' ' 121' ' ' ASN . 69.4 mt -113.84 158.38 21.1 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.03 0.443 . . . . 0.26 111.25 -175.26 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -148.71 145.68 27.78 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.814 -0.81 . . . . 0.66 108.814 176.055 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.1 t -114.63 109.3 18.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.009 0.433 . . . . 0.3 111.433 -177.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -106.82 103.54 47.61 Favored Pre-proline 0 CA--C 1.532 0.262 0 N-CA-C 108.672 -0.862 . . . . 1.29 108.672 169.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 91' ' ' PRO . 23.2 Cg_endo -62.08 141.86 90.29 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 CA-C-N 120.593 1.248 . . . . 0.51 111.457 -171.475 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 90' ' ' PRO . 89.4 Cg_endo -95.38 14.48 41.32 Favored 'Cis proline' 0 N--CA 1.497 1.724 0 CA-C-N 121.143 1.444 . . . . 0.45 113.649 -3.245 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -107.45 136.64 46.9 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 122.525 -0.11 . . . . 1.29 110.896 -175.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.464 HD22 ' OG ' ' A' ' 117' ' ' SER . 36.5 tp -92.93 136.58 33.12 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 120.503 -0.479 . . . . 0.23 110.63 -176.604 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.5 HD11 ' CG2' ' A' ' 102' ' ' ILE . 8.7 tp -124.02 139.64 53.75 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.068 -0.515 . . . . 0.26 110.324 -173.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.1 p90 -143.96 153.95 42.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.822 0.344 . . . . 1.23 110.586 176.194 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 27.0 mtm105 -101.98 146.82 27.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.103 -0.499 . . . . 1.56 110.606 -178.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 16.5 t30 -129.97 168.43 16.69 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.667 0.746 . . . . 1.66 111.552 -177.659 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -47.08 145.8 2.01 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.566 -0.743 . . . . 2.32 112.233 -176.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 60.3 mtp180 63.82 30.91 14.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.168 -0.924 . . . . 3.51 112.146 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.2 m 65.19 35.12 8.01 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.949 0.404 . . . . 1.3 111.524 167.12 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 36.2 mtp180 -98.28 151.98 19.91 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.307 -0.627 . . . . 2.68 109.307 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.669 HD13 ' CH2' ' B' 1345 ' ' TRP . 72.3 mt -117.12 127.52 74.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 121.153 0.502 . . . . 0.23 110.068 -176.761 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 81.0 mtt85 -138.41 150.33 46.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.66 -0.7 . . . . 1.75 109.495 178.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.7 168.77 26.26 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 120.787 -0.72 . . . . 0.2 111.81 -176.842 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -125.27 135.02 52.1 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.279 -0.46 . . . . 1.45 110.269 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 46.5 t90 -107.46 131.01 54.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.012 -0.54 . . . . 0.78 109.899 177.37 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -117.17 149.77 39.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.792 0.329 . . . . 1.18 110.602 -179.386 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -52.63 -37.71 58.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.137 -0.483 . . . . 1.21 111.441 176.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.5 t-20 -131.28 135.2 47.1 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.467 -0.333 . . . . 0.33 110.53 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.7 t -61.97 -41.99 98.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.271 -0.422 . . . . 1.38 111.084 -177.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -60.03 -43.68 95.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.432 0.634 . . . . 0.97 110.096 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -56.43 -44.59 80.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.635 -0.711 . . . . 0.14 109.996 178.309 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 38.0 t -59.83 -38.5 82.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.494 -0.775 . . . . 0.24 110.732 177.551 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -59.11 -46.32 88.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.917 0.389 . . . . 1.63 110.527 -177.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 -59.54 -49.17 78.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.141 0.496 . . . . 3.38 110.599 -177.842 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.657 HG23 HD11 ' A' ' 54' ' ' ILE . 27.5 mm -58.49 -46.51 89.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.42 0.629 . . . . 0.13 109.973 -178.393 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.464 ' OG ' HD22 ' A' ' 93' ' ' LEU . 20.9 m -58.65 -40.9 84.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.97 -0.559 . . . . 0.76 110.682 -177.734 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -56.9 -42.43 92.34 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 110.688 -0.965 . . . . 0.18 110.688 -179.322 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.545 HD12 ' HA ' ' A' ' 116' ' ' ILE . 16.0 mt -57.79 -50.05 74.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.438 0.637 . . . . 0.18 110.275 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 53.1 t -58.46 -43.62 87.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.546 -0.752 . . . . 0.23 110.109 -177.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.478 ' ND2' HD12 ' A' ' 86' ' ' LEU . 24.4 m120 -57.45 -41.51 80.65 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.3 -0.409 . . . . 1.04 110.634 -178.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.43 -45.63 95.5 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 111.184 -0.766 . . . . 0.29 111.184 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 66.8 mt -57.89 -41.7 83.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.899 0.38 . . . . 0.33 110.621 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 88.5 mt . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.007 -0.542 . . . . 0.55 110.749 -179.296 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 8.4 mt . . . . . 0 CA--C 1.53 0.197 0 N-CA-C 109.59 -0.522 . . . . 0.51 109.59 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -79.06 139.79 15.37 Favored 'Trans proline' 0 N--CA 1.492 1.386 0 C-N-CA 121.057 1.171 . . . . 0.6 111.08 174.397 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -97.17 125.78 44.54 Favored Pre-proline 0 CA--C 1.535 0.391 0 CA-C-O 118.512 -0.756 . . . . 2.42 109.955 179.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -78.18 169.04 20.9 Favored 'Trans proline' 0 N--CA 1.497 1.721 0 C-N-CA 121.311 1.34 . . . . 0.7 112.015 176.469 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -65.18 157.08 59.46 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 121.328 1.352 . . . . 0.67 111.396 176.357 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 9.8 tt -50.0 -32.82 16.14 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.131 0.419 . . . . 1.84 112.131 -176.583 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 58.4 t80 -54.28 -36.16 63.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.85 0.357 . . . . 3.35 111.418 -176.479 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B 1345 ' ' TRP . . . . . 0.669 ' CH2' HD13 ' A' ' 102' ' ' ILE . 12.1 t90 -61.75 -48.18 81.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.37 -0.377 . . . . 0.37 110.448 -176.789 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -62.45 -47.93 81.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.042 0.449 . . . . 1.82 110.574 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -59.45 -44.49 92.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.142 -0.481 . . . . 2.4 110.905 -177.31 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -59.03 -46.39 88.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.249 -0.432 . . . . 1.53 110.654 -176.608 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.53 -48.0 83.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.113 0.482 . . . . 0.43 110.631 -177.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 115.974 -0.557 . . . . 2.09 111.141 -176.818 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.6 p . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.89 0.376 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mm -60.39 -47.18 93.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.0 0.429 . . . . 0.0 110.211 -178.165 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.6 m -58.94 -43.88 91.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.565 -177.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.0 mtp85 -59.75 -44.95 93.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.626 -178.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 97.2 mmm -58.24 -43.92 88.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.005 0.431 . . . . 0.0 110.425 -178.111 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -60.7 -49.69 76.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.271 -178.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.657 ' HA ' HD12 ' A' ' 14' ' ' ILE . 10.6 tp -59.33 -32.9 70.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.05 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.69 -50.68 68.26 Favored 'General case' 0 C--N 1.332 -0.166 0 O-C-N 122.294 -0.254 . . . . 0.0 110.906 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.75 -41.71 82.45 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.99 0.424 . . . . 0.0 110.502 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.657 HD12 ' HA ' ' A' ' 11' ' ' LEU . 94.9 mt -54.18 -53.07 31.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.715 177.782 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -52.88 -21.34 4.16 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -57.91 -35.4 71.01 Favored 'General case' 0 C--N 1.332 -0.169 0 O-C-N 122.33 -0.231 . . . . 0.0 111.477 -177.775 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.656 HG21 ' HB2' ' A' ' 75' ' ' SER . 45.8 mm -113.01 -39.78 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-O 120.776 0.322 . . . . 0.0 110.554 -177.202 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -117.29 77.2 9.65 Favored Pre-proline 0 CA--C 1.535 0.367 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.162 -178.127 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -55.69 -21.49 32.13 Favored 'Trans proline' 0 N--CA 1.498 1.738 0 C-N-CA 121.512 1.475 . . . . 0.0 113.396 -175.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -88.69 8.76 27.04 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -174.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -86.81 124.77 33.42 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 174.263 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.594 ' O ' HD21 ' A' ' 11' ' ' LEU . 67.7 mttm -105.61 -39.35 6.12 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.798 0.332 . . . . 0.0 111.173 -174.025 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -134.72 144.78 47.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.97 0.414 . . . . 0.0 111.064 -176.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.405 HD11 HD12 ' A' ' 14' ' ' ILE . 24.4 mt -96.34 131.32 43.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 172.59 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.1 t -91.49 -47.19 14.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 0.0 109.929 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.492 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -153.03 152.01 30.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.844 178.486 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.9 p -139.86 131.94 27.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.083 0.468 . . . . 0.0 110.958 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 45.0 t -105.37 126.9 52.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.654 176.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.1 m -54.4 -38.9 66.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.191 -172.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -151.31 127.04 10.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.217 0.532 . . . . 0.0 111.501 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.464 HG22 ' CD2' ' A' ' 107' ' ' PHE . 96.5 t -144.91 142.31 22.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.526 -177.613 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -131.53 149.87 52.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.203 -178.033 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.438 ' HD2' HG21 ' A' ' 46' ' ' THR . 20.5 t80 -100.68 131.33 46.64 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.656 -176.555 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -127.16 144.45 51.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.819 178.011 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 74.7 m -122.46 149.48 43.81 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.574 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -109.48 131.93 54.61 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.854 0.359 . . . . 0.0 110.316 175.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.0 t-20 -103.92 114.7 29.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.73 176.457 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 84.8 p -68.6 -31.41 70.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.058 -177.001 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.2 m -61.91 -38.61 89.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.686 0.279 . . . . 0.0 110.964 -177.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -95.1 -21.44 18.54 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -178.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 51.0 t30 68.95 45.65 0.92 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-O 121.411 0.624 . . . . 0.0 109.343 -177.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 76.8 tt0 -151.49 150.58 30.54 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.281 -176.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 78.2 m95 -85.32 138.46 32.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.871 175.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -122.05 126.39 48.37 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 177.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -73.8 139.71 45.35 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 177.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.438 HG21 ' HD2' ' A' ' 33' ' ' PHE . 69.7 p -92.31 175.42 6.85 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.181 -178.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.6 p30 -86.51 13.71 7.98 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.1 t -108.5 106.42 20.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 121.047 0.451 . . . . 0.0 110.342 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -131.49 112.1 12.36 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 174.215 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.64 176.56 38.95 Favored Glycine 0 CA--C 1.522 0.48 0 C-N-CA 120.125 -1.036 . . . . 0.0 112.283 -168.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.491 ' HB2' HH21 ' A' ' 70' ' ' ARG . . . -77.47 135.85 38.3 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 174.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -103.04 126.96 50.45 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.368 -175.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.475 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 5.0 m-85 -130.04 142.07 50.66 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.744 0.307 . . . . 0.0 110.72 177.105 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.59 HD11 HG23 ' A' ' 116' ' ' ILE . 68.3 mt -101.59 126.9 55.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 171.044 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.62 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 14.2 m-30 -108.65 138.56 44.77 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.995 0.426 . . . . 0.0 111.552 -177.133 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -108.82 143.34 38.13 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.976 173.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -140.49 146.34 38.05 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.111 178.288 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -86.88 28.11 0.93 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 112.1 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.97 162.77 38.22 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -63.91 129.88 94.13 Favored Pre-proline 0 CA--C 1.539 0.528 0 CA-C-O 118.448 -0.787 . . . . 0.0 110.002 -177.47 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -73.46 140.93 70.01 Favored 'Cis proline' 0 N--CA 1.498 1.793 0 CA-C-N 121.867 1.703 . . . . 0.0 111.681 -1.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -63.09 -40.73 98.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.925 -177.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.475 ' HB3' HD12 ' A' ' 80' ' ' ILE . 77.9 m80 -143.02 140.51 31.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.401 0.619 . . . . 0.0 110.944 -177.151 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.5 t -149.81 152.31 34.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.281 -178.046 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.428 HG13 HD11 ' A' ' 80' ' ' ILE . 53.1 mt -116.13 138.65 45.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 -177.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -131.87 142.09 49.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.135 -176.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.6 mt -121.05 131.47 72.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.186 0.517 . . . . 0.0 109.833 172.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -98.71 99.56 10.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.902 -1.044 . . . . 0.0 109.335 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.4 t-20 -73.2 107.71 5.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.271 0.558 . . . . 0.0 111.268 -174.376 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.491 HH21 ' HB2' ' A' ' 51' ' ' ALA . 96.8 mtt180 -73.47 -39.38 64.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.272 -172.312 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 70.2 mt -73.23 -45.19 57.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.719 -174.347 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -95.05 -3.42 48.27 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.753 1.019 . . . . 0.0 113.753 -175.506 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.8 m 55.95 43.14 27.82 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 121.477 0.656 . . . . 0.0 110.49 177.551 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.8 m -130.13 149.02 52.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.332 -178.309 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.656 ' HB2' HG21 ' A' ' 17' ' ' ILE . 4.0 p -102.66 139.98 37.54 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.094 -179.126 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -134.64 122.25 22.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.185 177.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.7 p -125.55 148.49 30.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.038 -177.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 55.5 tt0 -148.66 137.07 11.62 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-O 119.063 -0.494 . . . . 0.0 110.622 175.149 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.53 150.95 36.63 Favored 'Trans proline' 0 N--CA 1.498 1.744 0 C-N-CA 121.67 1.58 . . . . 0.0 112.268 178.382 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.475 HD12 ' HB3' ' A' ' 63' ' ' HIS . 63.4 mt -89.42 121.07 39.15 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 C-N-CA 120.711 -0.395 . . . . 0.0 110.363 178.037 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 71.0 p -99.1 160.8 14.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.052 176.238 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -97.38 7.31 63.83 Favored Glycine 0 CA--C 1.533 1.215 0 C-N-CA 120.877 -0.678 . . . . 0.0 113.607 -178.256 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.7 p -99.04 -3.75 34.04 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 117.927 0.863 . . . . 0.0 113.015 177.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.0 mt -68.36 144.45 54.77 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 118.1 0.409 . . . . 0.0 111.166 -177.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.1 tt0 -115.97 135.84 53.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.78 176.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.403 HD12 ' OD1' ' A' ' 121' ' ' ASN . 60.0 mt -117.23 157.74 25.51 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.896 0.379 . . . . 0.0 110.854 -176.15 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -150.14 143.36 25.0 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.0 t -98.59 109.11 21.92 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.491 178.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.4 ' HG3' HD22 ' A' ' 94' ' ' LEU . 20.9 mm-40 -106.87 103.75 48.64 Favored Pre-proline 0 C--N 1.328 -0.329 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 172.273 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -70.4 143.11 46.82 Favored 'Trans proline' 0 N--CA 1.497 1.702 0 CA-C-N 120.541 1.229 . . . . 0.0 112.027 -171.292 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -90.94 14.59 50.13 Favored 'Cis proline' 0 N--CA 1.5 1.858 0 CA-C-N 121.041 1.407 . . . . 0.0 113.481 -3.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -95.97 172.28 8.1 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.531 0.205 . . . . 0.0 110.627 -177.476 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.8 tp -113.98 135.01 54.46 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 172.35 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.402 HD21 ' HZ2' ' B' 1345 ' ' TRP . 9.0 tp -126.02 139.19 53.62 Favored 'General case' 0 C--N 1.333 -0.114 0 N-CA-C 110.428 -0.212 . . . . 0.0 110.428 -173.751 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 50.8 p90 -145.97 154.43 41.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.965 0.412 . . . . 0.0 110.627 174.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.6 mtm180 -104.75 149.13 25.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.729 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -129.96 165.56 21.87 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.856 0.836 . . . . 0.0 111.549 -178.154 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -48.45 146.54 2.86 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.524 -0.762 . . . . 0.0 112.1 -176.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 38.8 ttp180 65.23 30.95 11.08 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.289 -0.869 . . . . 0.0 112.041 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 46.9 t 66.05 35.23 6.43 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.858 0.361 . . . . 0.0 111.538 166.104 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 18.7 mmm180 -97.89 148.24 23.63 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.258 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 76.9 mt -113.66 128.55 70.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -178.319 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -138.75 150.31 45.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.535 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.33 169.32 25.89 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 111.494 -0.642 . . . . 0.0 111.494 -175.665 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -125.19 139.87 53.36 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 120.951 0.405 . . . . 0.0 110.909 -177.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 65.5 t90 -106.22 125.39 50.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.533 174.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.464 ' CD2' HG22 ' A' ' 31' ' ' VAL . 67.7 m-85 -117.19 140.31 49.69 Favored 'General case' 0 C--N 1.33 -0.258 0 O-C-N 123.262 0.351 . . . . 0.0 110.539 -179.655 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -50.49 -39.71 49.17 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.908 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -131.72 137.26 48.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.664 0.268 . . . . 0.0 110.372 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 84.3 p -62.28 -42.28 99.21 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.144 -177.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -59.01 -44.19 91.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.431 0.634 . . . . 0.0 109.961 178.655 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -55.94 -44.22 78.18 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.152 178.403 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 49.2 t -60.07 -40.65 90.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.594 178.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -59.09 -46.1 89.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.904 0.383 . . . . 0.0 110.634 -176.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.0 mtm180 -61.04 -49.38 77.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.817 -177.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.59 HG23 HD11 ' A' ' 54' ' ' ILE . 26.8 mm -58.65 -44.3 89.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.996 0.427 . . . . 0.0 109.963 -178.433 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.8 m -59.36 -44.19 92.74 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.667 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.59 -44.36 93.92 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 -178.681 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.492 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.2 mt -59.03 -49.09 79.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.145 0.498 . . . . 0.0 110.607 -178.37 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 56.9 t -58.97 -42.66 86.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.164 -178.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.403 ' OD1' HD12 ' A' ' 86' ' ' LEU . 83.6 m-20 -57.74 -42.75 84.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.881 0.372 . . . . 0.0 110.552 -178.765 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.65 -42.28 99.73 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 -179.215 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.4 mt -62.69 -43.12 99.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.774 0.321 . . . . 0.0 111.105 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 65.4 mt . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.458 -176.509 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 17.7 mt . . . . . 0 CA--C 1.53 0.198 0 CA-C-O 119.354 -0.355 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.17 139.87 15.25 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 C-N-CA 121.163 1.242 . . . . 0.0 110.981 173.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 49.0 mmtt -97.11 125.76 44.74 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-O 118.892 -0.575 . . . . 0.0 109.982 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -75.8 154.13 38.58 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 121.392 1.394 . . . . 0.0 111.381 171.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -51.68 152.11 13.5 Favored 'Trans proline' 0 N--CA 1.496 1.633 0 C-N-CA 121.271 1.314 . . . . 0.0 111.621 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.3 tp -50.0 -29.74 9.23 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -177.374 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -55.15 -37.27 66.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.815 0.34 . . . . 0.0 111.223 -177.196 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B 1345 ' ' TRP . . . . . 0.402 ' HZ2' HD21 ' A' ' 94' ' ' LEU . 35.5 t90 -60.89 -48.03 83.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.181 -177.404 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -61.7 -49.44 76.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.088 0.471 . . . . 0.0 110.482 -177.078 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -59.96 -45.44 92.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.974 -176.176 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -59.44 -47.33 85.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.713 -175.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.73 -48.56 81.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.823 -176.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.144 -175.592 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.2 t . . . . . 0 CA--C 1.526 0.045 0 CA-C-O 120.954 0.407 . . . . 0.0 110.594 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.2 mm -59.87 -46.07 94.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.133 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.2 m -58.84 -44.71 90.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.449 -177.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -59.7 -45.13 93.05 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.66 -178.518 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 89.6 mtp -58.25 -42.92 87.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.996 0.427 . . . . 0.0 110.416 -178.436 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -60.13 -49.97 75.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.216 -178.484 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.75 ' HA ' HD12 ' A' ' 14' ' ' ILE . 14.2 tp -61.31 -30.5 70.54 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.631 -0.427 . . . . 0.0 111.342 -179.566 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.57 -49.78 73.89 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 122.219 -0.301 . . . . 0.0 110.505 178.188 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.16 -42.32 85.74 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.032 0.444 . . . . 0.0 110.336 178.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.75 HD12 ' HA ' ' A' ' 11' ' ' LEU . 95.6 mt -54.24 -52.98 33.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.755 178.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -55.62 -26.55 44.71 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -177.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 52.8 mttm -59.98 -30.82 69.37 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -177.533 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.9 mm -107.63 -42.49 6.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.843 0.354 . . . . 0.0 110.319 -176.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -114.7 84.6 10.35 Favored Pre-proline 0 CA--C 1.533 0.315 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.473 -176.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -53.11 -22.95 20.72 Favored 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 121.528 1.486 . . . . 0.0 113.338 -177.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.2 p90 -97.51 22.07 9.39 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 -175.504 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -107.89 122.4 46.72 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 171.628 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.476 ' O ' HD21 ' A' ' 11' ' ' LEU . 46.1 mtmt -116.71 -30.14 5.88 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -174.626 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -128.84 142.25 51.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.763 0.316 . . . . 0.0 110.862 -178.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.474 HG13 HD13 ' A' ' 11' ' ' LEU . 57.6 mt -98.98 132.42 44.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.85 174.127 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 43.6 t -94.41 -47.14 13.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.195 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.504 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.1 t0 -154.05 153.76 32.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.181 178.752 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.5 p -141.72 131.99 24.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.943 0.401 . . . . 0.0 110.749 178.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 38.3 t -106.98 129.15 54.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.726 176.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.8 m -54.27 -38.22 65.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.252 -172.563 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -152.73 126.66 9.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.141 0.496 . . . . 0.0 111.759 -178.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 99.3 t -145.19 142.64 22.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.534 -177.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.93 149.89 50.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.68 -0.236 . . . . 0.0 111.022 -179.06 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -98.72 132.58 43.99 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.33 0.586 . . . . 0.0 111.602 -177.145 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -129.54 143.94 51.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.666 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 96.5 m -121.98 149.56 43.29 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.834 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -110.91 131.99 54.58 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.997 0.427 . . . . 0.0 110.535 177.064 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 -104.41 114.91 29.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.811 176.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.1 m -67.84 -32.69 73.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.987 -177.012 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.0 t -60.27 -39.48 86.96 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.719 0.295 . . . . 0.0 110.9 -177.327 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -94.45 -21.42 18.92 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 26.5 t30 69.41 43.78 1.0 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.348 0.594 . . . . 0.0 109.739 -177.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.5 mt-10 -150.43 161.83 41.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.124 -177.588 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.439 ' CB ' HD12 ' B' 1338 ' ' LEU . 81.8 m95 -94.89 140.0 30.54 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.416 177.579 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -119.75 126.42 51.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.477 . . . . 0.0 109.951 176.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.9 ttpm? -74.4 140.12 44.51 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 178.427 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 74.3 p -92.25 176.46 6.48 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.412 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -88.36 13.39 11.81 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 45.2 t -108.1 106.42 20.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 121.03 0.443 . . . . 0.0 110.475 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -129.35 112.75 14.16 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 174.52 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.56 38.96 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 120.114 -1.041 . . . . 0.0 112.237 -168.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.47 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.38 136.42 37.67 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 175.25 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -100.91 126.28 47.53 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.178 -175.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.47 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 6.0 m-85 -129.58 142.25 50.79 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.744 0.307 . . . . 0.0 110.55 177.174 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.658 HD11 HG23 ' A' ' 116' ' ' ILE . 68.9 mt -101.61 126.87 55.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 171.744 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.683 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 14.3 m-30 -108.58 137.48 46.46 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.827 0.346 . . . . 0.0 111.229 -177.096 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 50.9 t60 -112.07 143.25 43.39 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.004 174.344 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 33.8 tpt85 -142.21 147.89 37.29 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.268 177.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -86.94 28.21 0.93 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.218 -0.447 . . . . 0.0 112.077 -179.421 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.02 169.79 23.77 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -64.01 125.25 87.58 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.982 -178.416 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -78.34 140.97 63.2 Favored 'Cis proline' 0 N--CA 1.496 1.642 0 CA-C-N 121.911 1.718 . . . . 0.0 111.843 -1.438 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -61.54 -42.22 98.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.903 -177.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.459 ' HB3' HD12 ' A' ' 80' ' ' ILE . 77.5 m80 -143.63 139.8 29.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.353 0.596 . . . . 0.0 110.891 -177.514 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.3 t -149.9 151.26 33.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.303 -177.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.442 HG13 HD11 ' A' ' 80' ' ' ILE . 48.1 mt -113.47 137.67 45.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 -178.469 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -131.82 142.2 49.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.355 -176.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.4 mt -120.66 130.35 74.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 121.202 0.525 . . . . 0.0 109.662 172.251 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -96.96 99.56 11.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.937 -1.029 . . . . 0.0 109.205 179.308 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -71.89 107.58 4.72 Favored 'General case' 0 C--N 1.332 -0.181 0 O-C-N 123.666 0.604 . . . . 0.0 111.089 -174.665 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 78.3 ttt-85 -73.33 -42.41 62.33 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.397 -171.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 48.7 mt -72.27 -45.09 61.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.633 -175.158 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -95.08 -3.22 48.55 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 -175.566 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 69.7 p 50.93 42.64 28.44 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.511 0.672 . . . . 0.0 111.183 177.58 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 32.4 m -127.67 135.53 50.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.334 -179.357 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.3 p -85.36 136.81 33.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.354 -178.14 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -132.71 122.17 24.2 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.347 175.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 13.2 p -125.59 150.31 30.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.209 -178.045 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -148.28 136.37 11.2 Favored Pre-proline 0 CA--C 1.537 0.466 0 CA-C-O 119.106 -0.473 . . . . 0.0 110.567 174.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -75.43 151.01 37.13 Favored 'Trans proline' 0 N--CA 1.498 1.774 0 C-N-CA 121.704 1.602 . . . . 0.0 112.403 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.459 HD12 ' HB3' ' A' ' 63' ' ' HIS . 64.5 mt -90.78 125.44 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.151 177.388 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.414 ' H ' HD11 ' A' ' 84' ' ' LEU . 40.6 p -98.49 160.29 14.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.264 176.655 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -82.35 -22.09 59.36 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 121.218 -0.515 . . . . 0.0 113.124 -176.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.9 p -87.02 10.15 17.39 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -177.123 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.414 HD11 ' H ' ' A' ' 81' ' ' THR . 76.7 mt -66.88 131.82 46.7 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 118.109 0.413 . . . . 0.0 111.098 -177.648 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -112.35 135.8 52.6 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.901 176.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 70.5 mt -119.23 157.83 27.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.023 0.439 . . . . 0.0 111.087 -175.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -144.08 135.71 25.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.473 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.0 t -97.72 109.33 22.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.994 0.426 . . . . 0.0 111.241 -177.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 12.6 mt-30 -106.57 129.22 24.79 Favored Pre-proline 0 CA--C 1.534 0.362 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 173.094 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -79.26 128.95 8.42 Favored 'Trans proline' 0 N--CA 1.494 1.551 0 CA-C-N 120.651 1.268 . . . . 0.0 111.878 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -98.71 19.25 26.22 Favored 'Cis proline' 0 N--CA 1.5 1.889 0 CA-C-N 122.121 1.793 . . . . 0.0 113.026 -6.759 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -112.58 132.94 54.88 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.713 0.292 . . . . 0.0 111.371 -171.349 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 35.5 tp -90.22 135.04 33.91 Favored 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.702 -172.421 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.427 HD11 ' CG2' ' A' ' 102' ' ' ILE . 7.5 tp -123.53 143.01 50.46 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.519 -175.419 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 33.8 p90 -143.38 152.27 41.4 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.835 0.35 . . . . 0.0 110.199 175.266 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 27.0 mtm180 -104.64 144.58 31.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.714 -176.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -129.1 167.76 17.09 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.915 0.864 . . . . 0.0 111.619 -177.31 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 52.1 tt0 -48.52 149.33 1.68 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.983 -176.286 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 62.05 30.96 18.03 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.212 -0.904 . . . . 0.0 112.172 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 7.5 m 65.11 35.29 8.04 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.842 0.354 . . . . 0.0 111.541 166.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 90.0 mtt-85 -97.48 147.02 24.66 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.65 HD13 ' CH2' ' B' 1345 ' ' TRP . 73.0 mt -115.57 124.19 71.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 -177.449 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 81.1 mtm180 -137.24 150.32 47.76 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -146.6 169.44 27.8 Favored Glycine 0 CA--C 1.523 0.555 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.956 -175.034 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -125.15 136.53 53.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.165 -0.517 . . . . 0.0 110.534 -178.377 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 70.4 t90 -106.57 125.82 51.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.597 176.047 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -113.47 146.36 39.71 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.837 0.351 . . . . 0.0 110.646 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -52.32 -36.13 52.51 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.569 177.235 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 33.1 t-20 -133.21 133.75 43.15 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.786 0.327 . . . . 0.0 110.491 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 22.9 m -61.21 -40.64 94.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.169 -178.049 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -61.0 -43.18 99.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.322 0.582 . . . . 0.0 110.189 179.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -57.0 -45.19 83.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.569 0.699 . . . . 0.0 110.032 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 46.8 t -59.58 -38.56 81.52 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.766 177.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -58.63 -45.52 89.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.888 0.375 . . . . 0.0 110.484 -177.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 64.1 mtp85 -59.74 -48.22 82.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.539 -178.47 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.658 HG23 HD11 ' A' ' 54' ' ' ILE . 30.5 mm -58.2 -44.97 88.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.093 0.473 . . . . 0.0 110.044 -178.89 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 54.3 p -59.51 -44.6 93.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.715 -177.421 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.51 -43.25 94.17 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.655 -0.978 . . . . 0.0 110.655 -178.72 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.504 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.6 mt -59.07 -49.13 79.06 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.154 0.502 . . . . 0.0 110.552 -178.63 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 53.2 t -58.54 -43.05 86.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.207 -177.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -58.24 -43.86 88.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.643 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.51 -38.99 96.71 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.461 -0.656 . . . . 0.0 111.461 -179.01 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 36.8 mt -65.3 -43.98 89.37 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.624 0.249 . . . . 0.0 111.341 179.484 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 40.8 mt . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.078 -176.564 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B 1338 ' ' LEU . . . . . 0.439 HD12 ' CB ' ' A' ' 43' ' ' TRP . 17.0 mt . . . . . 0 C--O 1.233 0.199 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.07 139.79 15.36 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 C-N-CA 121.091 1.194 . . . . 0.0 111.158 174.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -97.14 125.88 44.2 Favored Pre-proline 0 CA--C 1.535 0.394 0 CA-C-O 118.442 -0.79 . . . . 0.0 109.706 179.214 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -78.1 167.12 23.88 Favored 'Trans proline' 0 N--CA 1.496 1.63 0 CA-C-N 120.607 1.253 . . . . 0.0 111.813 177.625 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -61.54 156.35 47.64 Favored 'Trans proline' 0 N--CA 1.494 1.551 0 C-N-CA 121.292 1.328 . . . . 0.0 111.218 177.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 23.8 tp -49.95 -30.15 9.82 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -176.608 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -56.53 -36.72 69.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.762 0.315 . . . . 0.0 111.388 -176.58 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B 1345 ' ' TRP . . . . . 0.65 ' CH2' HD13 ' A' ' 102' ' ' ILE . 5.9 t90 -61.54 -48.19 82.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.851 0.358 . . . . 0.0 110.309 -176.092 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -64.88 -48.66 73.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.041 0.448 . . . . 0.0 110.863 -178.29 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 61.8 tt0 -58.56 -43.36 89.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.883 -176.588 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -59.74 -48.16 82.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.597 -176.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -58.21 -47.59 83.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.135 0.493 . . . . 0.0 110.617 -177.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.295 -176.647 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 16.6 t . . . . . 0 C--O 1.231 0.103 0 CA-C-O 121.078 0.466 . . . . 0.0 110.339 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 45.5 mm -59.54 -41.25 84.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.242 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.8 m -60.05 -45.18 93.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.881 0.372 . . . . 0.0 110.631 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 59.9 ttt85 -59.66 -46.98 87.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.993 0.425 . . . . 0.0 110.459 -178.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 86.1 mtp -58.18 -43.13 87.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.232 0.539 . . . . 0.0 110.375 -178.373 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -60.53 -48.3 82.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.33 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.675 ' HA ' HD12 ' A' ' 14' ' ' ILE . 8.4 tp -60.5 -33.63 72.9 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.058 -178.574 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.47 -50.04 73.02 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.655 0.264 . . . . 0.0 110.608 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.16 -41.36 88.19 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.005 0.431 . . . . 0.0 110.553 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.688 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 95.6 mt -54.18 -52.97 32.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.53 178.511 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -53.28 -25.33 14.27 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -177.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 55.6 mttm -59.72 -32.65 70.73 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -177.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.2 mm -108.86 -42.78 5.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.958 0.409 . . . . 0.0 110.253 -177.136 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -117.18 77.32 9.37 Favored Pre-proline 0 CA--C 1.535 0.397 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.912 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -55.35 -20.6 26.22 Favored 'Trans proline' 0 N--CA 1.498 1.774 0 C-N-CA 121.481 1.454 . . . . 0.0 113.431 -175.208 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.4 p90 -90.6 10.23 26.42 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -174.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.74 126.45 32.4 Favored 'General case' 0 C--O 1.231 0.097 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 175.357 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -97.9 -40.47 8.48 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.799 -0.361 . . . . 0.0 110.778 -176.186 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -153.05 156.73 39.3 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.549 -0.461 . . . . 0.0 111.565 -179.47 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 61.8 mt -93.16 138.1 20.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.068 177.744 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.2 t -90.05 -45.97 15.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.684 176.753 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.507 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.9 t0 -156.74 157.62 35.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.85 178.09 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.6 p -142.49 132.32 24.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.138 0.494 . . . . 0.0 111.205 -179.631 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 24.7 t -106.16 124.46 49.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.5 176.394 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.3 m -54.12 -38.22 65.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.302 -171.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 52.7 t-80 -150.39 126.46 10.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.19 0.519 . . . . 0.0 111.651 -178.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.454 HG21 ' HB3' ' A' ' 52' ' ' PHE . 93.4 t -145.14 138.18 21.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.403 -177.523 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -126.26 149.84 48.82 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.029 -178.256 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.407 ' HD1' HG21 ' A' ' 46' ' ' THR . 18.9 t80 -98.76 129.99 45.21 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 121.319 0.58 . . . . 0.0 111.682 -176.484 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -125.43 142.86 51.27 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.461 178.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 90.1 m -121.66 146.61 46.83 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.307 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -108.37 131.96 54.22 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.929 0.395 . . . . 0.0 110.395 176.448 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 31.3 t-20 -104.3 116.13 31.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.91 177.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 86.1 p -68.63 -31.89 71.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.966 -177.162 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.7 m -61.31 -39.36 90.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.777 0.322 . . . . 0.0 110.909 -177.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -93.7 -21.4 19.37 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 28.1 t30 68.96 42.95 1.22 Allowed 'General case' 0 C--O 1.232 0.134 0 CA-C-O 121.299 0.571 . . . . 0.0 109.8 -177.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -151.54 163.99 37.82 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.106 -177.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.441 ' CB ' HD12 ' B' 1338 ' ' LEU . 83.0 m95 -94.92 140.92 29.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.322 177.592 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -122.89 131.34 53.7 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 176.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -76.15 139.79 41.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.278 178.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.407 HG21 ' HD1' ' A' ' 33' ' ' PHE . 66.3 p -92.32 171.99 8.7 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.699 -0.401 . . . . 0.0 109.944 178.934 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -85.81 13.82 6.79 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 178.122 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.6 t -105.15 106.47 20.57 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 CA-C-O 120.959 0.409 . . . . 0.0 110.464 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -130.34 114.94 16.23 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 175.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.58 176.47 38.91 Favored Glycine 0 CA--C 1.52 0.384 0 C-N-CA 120.065 -1.064 . . . . 0.0 112.372 -169.003 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.465 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -81.64 135.97 35.53 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 175.374 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.454 ' HB3' HG21 ' A' ' 31' ' ' VAL . 7.2 t80 -99.55 128.83 45.67 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.127 -176.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.465 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.2 m-85 -132.08 143.53 50.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.339 177.566 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.665 HD11 HG23 ' A' ' 116' ' ' ILE . 68.9 mt -101.51 128.41 53.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 171.624 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.688 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 14.8 m-30 -108.54 135.56 49.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.007 0.432 . . . . 0.0 111.189 -175.158 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -115.42 142.48 46.65 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.098 176.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -142.07 146.98 36.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.089 178.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -86.87 28.01 0.94 Allowed 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 178.7 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.36 165.42 34.77 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -63.89 130.34 94.4 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-O 118.563 -0.732 . . . . 0.0 110.206 -177.42 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -72.84 140.87 69.42 Favored 'Cis proline' 0 N--CA 1.497 1.694 0 CA-C-N 121.717 1.649 . . . . 0.0 111.331 -3.15 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -66.45 -43.47 85.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.025 -177.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.449 ' CD2' HD22 ' A' ' 123' ' ' LEU . 69.3 m80 -141.78 136.63 30.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.296 0.569 . . . . 0.0 110.768 -176.742 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.1 t -151.03 152.25 33.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.476 -178.091 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.466 HG13 HD11 ' A' ' 80' ' ' ILE . 43.9 mt -109.3 140.07 29.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -131.75 141.99 49.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.733 -177.274 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.4 mt -126.48 130.12 71.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.265 0.555 . . . . 0.0 110.076 173.579 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -97.81 99.86 11.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 114.946 -1.025 . . . . 0.0 109.776 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -73.27 107.12 5.41 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.802 0.689 . . . . 0.0 110.958 -176.675 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -71.81 -49.2 40.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.456 -171.477 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 44.0 mt -67.49 -45.01 77.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.519 -175.06 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -95.08 -3.0 48.95 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -174.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 11.5 t 44.63 41.39 4.83 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.348 0.594 . . . . 0.0 112.015 178.357 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 40.1 m -121.25 137.5 54.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.074 -0.967 . . . . 0.0 109.87 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 77.5 p -81.06 132.99 35.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.586 -176.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -119.66 122.16 40.88 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 174.045 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 38.2 t -125.53 145.81 32.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 120.68 0.276 . . . . 0.0 110.672 -177.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -148.15 126.36 5.96 Favored Pre-proline 0 CA--C 1.538 0.514 0 CA-C-O 118.621 -0.704 . . . . 0.0 110.464 173.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -75.45 150.86 36.87 Favored 'Trans proline' 0 N--CA 1.499 1.838 0 C-N-CA 121.571 1.514 . . . . 0.0 112.316 177.778 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.466 HD11 HG13 ' A' ' 65' ' ' ILE . 67.3 mt -94.25 135.6 28.1 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-O 120.934 0.397 . . . . 0.0 110.077 177.212 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.5 p -132.1 157.7 43.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.795 177.416 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -89.57 32.93 4.55 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.286 -178.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t -111.07 -20.56 12.35 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 173.006 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.6 mt -68.69 146.49 52.93 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.878 0.37 . . . . 0.0 111.133 -176.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -121.78 135.91 54.93 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.847 176.134 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 65.5 mt -113.87 159.0 20.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.698 -177.107 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -148.01 141.51 25.4 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 177.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.9 t -107.12 109.32 21.13 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.92 0.39 . . . . 0.0 111.209 -178.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -106.79 103.63 47.88 Favored Pre-proline 0 CA--C 1.532 0.277 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 170.363 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -64.03 145.32 89.53 Favored 'Trans proline' 0 N--CA 1.497 1.722 0 CA-C-N 120.523 1.223 . . . . 0.0 111.85 -170.188 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -93.95 18.43 37.95 Favored 'Cis proline' 0 N--CA 1.498 1.779 0 CA-C-N 120.904 1.358 . . . . 0.0 113.183 -3.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -110.59 159.96 17.09 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 110.342 -0.244 . . . . 0.0 110.342 -176.091 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 31.3 tp -110.76 133.63 53.17 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 122.075 -0.39 . . . . 0.0 111.275 -177.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.459 HD11 ' CG2' ' A' ' 102' ' ' ILE . 9.2 tp -122.08 140.28 52.71 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.141 -174.798 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 36.2 p90 -143.16 157.83 44.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.776 0.322 . . . . 0.0 110.467 176.241 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 31.0 mtm105 -101.85 147.33 26.64 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.893 0.378 . . . . 0.0 110.917 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -128.51 160.8 31.19 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.968 0.889 . . . . 0.0 111.619 -177.563 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -48.75 148.97 1.91 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.06 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 43.5 mtp180 64.25 30.9 13.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.252 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 47.8 t 67.62 35.24 4.16 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.94 0.4 . . . . 0.0 111.586 165.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -101.89 151.26 22.31 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.633 HD13 ' CH2' ' B' 1345 ' ' TRP . 74.2 mt -114.1 126.19 71.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -138.06 150.37 46.84 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -148.51 169.46 29.09 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.043 -175.137 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -125.15 138.84 54.15 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.992 0.425 . . . . 0.0 110.663 -178.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 44.7 t90 -107.05 125.71 51.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.693 176.386 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.407 ' CD2' HG22 ' A' ' 31' ' ' VAL . 60.7 m-85 -111.68 144.4 41.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.827 0.346 . . . . 0.0 110.669 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -52.39 -38.03 57.94 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.553 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 -131.48 134.35 46.07 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.761 0.315 . . . . 0.0 110.494 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.8 m -61.87 -42.46 99.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.064 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -59.84 -43.39 94.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.371 0.605 . . . . 0.0 110.061 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -56.68 -44.22 81.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.509 0.671 . . . . 0.0 110.12 178.407 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 42.6 t -59.92 -40.27 88.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.675 178.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -59.57 -44.53 93.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.777 0.323 . . . . 0.0 110.674 -177.16 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -59.74 -49.5 77.5 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.011 0.434 . . . . 0.0 110.461 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.665 HG23 HD11 ' A' ' 54' ' ' ILE . 30.3 mm -58.3 -45.02 89.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.14 0.495 . . . . 0.0 110.038 -178.731 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 56.5 p -59.43 -43.51 93.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.733 -177.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.62 -43.9 94.13 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 110.653 -0.979 . . . . 0.0 110.653 -178.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.507 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.2 mt -59.12 -49.89 76.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.063 0.458 . . . . 0.0 110.601 -178.341 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 56.9 t -58.93 -42.81 87.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.129 -178.313 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -57.77 -43.25 85.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.535 -178.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -60.9 -44.97 97.46 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 111.016 -0.833 . . . . 0.0 111.016 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.449 HD22 ' CD2' ' A' ' 63' ' ' HIS . 61.7 mt -57.77 -42.87 84.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.966 0.413 . . . . 0.0 110.488 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 70.4 mt . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.686 -179.836 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B 1338 ' ' LEU . . . . . 0.441 HD12 ' CB ' ' A' ' 43' ' ' TRP . 17.6 mt . . . . . 0 CA--C 1.531 0.223 0 N-CA-C 109.97 -0.381 . . . . 0.0 109.97 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -79.17 139.86 15.24 Favored 'Trans proline' 0 N--CA 1.492 1.393 0 C-N-CA 121.2 1.267 . . . . 0.0 111.201 174.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -97.03 125.7 45.12 Favored Pre-proline 0 CA--C 1.535 0.377 0 CA-C-O 118.8 -0.619 . . . . 0.0 110.022 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -74.15 155.61 47.1 Favored 'Trans proline' 0 N--CA 1.496 1.636 0 C-N-CA 121.488 1.459 . . . . 0.0 111.774 173.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -53.63 154.68 15.37 Favored 'Trans proline' 0 N--CA 1.496 1.625 0 C-N-CA 121.341 1.361 . . . . 0.0 111.561 177.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B 1343 ' ' LEU . . . . . 0.541 ' H ' HD12 ' B' 1343 ' ' LEU . 6.2 mp -50.42 -29.63 10.63 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -176.678 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -55.52 -38.58 69.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.865 0.364 . . . . 0.0 111.138 -177.195 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B 1345 ' ' TRP . . . . . 0.633 ' CH2' HD13 ' A' ' 102' ' ' ILE . 8.9 t90 -60.97 -48.08 83.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.136 -177.336 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -61.29 -49.88 75.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.14 0.495 . . . . 0.0 110.592 -177.049 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -60.17 -46.21 90.45 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.006 -175.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -58.69 -46.15 87.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.717 -176.057 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.99 -49.32 77.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.881 -177.001 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 . . . . . 0 C--N 1.327 -0.396 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.312 -175.173 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.6 m . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.855 0.36 . . . . 0.0 110.737 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.3 mm -60.64 -47.3 93.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.203 -178.237 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 32.1 m -58.92 -43.67 91.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.531 -177.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -59.62 -45.35 92.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.488 -178.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 66.5 mtt -58.21 -44.35 88.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.117 0.484 . . . . 0.0 110.434 -178.124 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.9 m120 -60.37 -48.91 79.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.383 -178.284 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.628 ' HA ' HD12 ' A' ' 14' ' ' ILE . 9.4 tp -60.76 -32.89 72.18 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.21 -178.734 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.62 -49.92 73.3 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.638 0.256 . . . . 0.0 110.686 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.87 -41.95 88.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.021 0.439 . . . . 0.0 110.514 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.672 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 93.4 mt -54.27 -52.97 33.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.632 178.177 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -53.84 -20.72 6.23 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -58.29 -34.88 71.02 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 122.266 -0.271 . . . . 0.0 111.589 -178.211 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.728 HG21 ' CB ' ' A' ' 75' ' ' SER . 46.6 mm -112.97 -39.51 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 CA-C-O 120.757 0.313 . . . . 0.0 110.617 -177.277 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -117.18 77.2 9.29 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.178 -178.47 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -55.99 -21.09 32.59 Favored 'Trans proline' 0 N--CA 1.497 1.735 0 C-N-CA 121.491 1.461 . . . . 0.0 113.432 -175.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 37.2 p90 -89.11 7.05 37.1 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -174.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -80.61 122.67 27.37 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 174.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.0 ttmm -97.71 -40.4 8.59 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.846 -174.108 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -149.29 152.53 36.05 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.344 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 41.5 mt -93.27 137.18 23.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.875 177.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.1 t -90.21 -45.99 14.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.704 177.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.496 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -156.49 157.08 34.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.908 178.346 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.8 p -142.39 132.79 25.0 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.996 0.426 . . . . 0.0 111.12 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 14.9 t -107.83 126.35 52.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.663 175.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 88.1 p -54.81 -37.94 66.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.343 -171.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -150.31 125.91 10.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.116 0.484 . . . . 0.0 111.724 -178.172 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.449 HG22 ' CD1' ' A' ' 107' ' ' PHE . 95.6 t -145.24 143.67 21.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.774 -177.721 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -131.21 149.48 52.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.866 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -99.22 131.29 45.35 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.261 0.553 . . . . 0.0 111.475 -177.067 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -124.68 139.71 53.6 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.507 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 72.7 m -119.92 146.8 45.45 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 177.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -106.8 132.03 53.23 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 120.983 0.42 . . . . 0.0 110.381 175.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 30.3 t-20 -104.42 115.79 30.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.947 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.0 m -67.54 -33.01 74.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.899 -177.431 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.3 p -61.63 -38.57 88.17 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 121.023 -0.271 . . . . 0.0 110.916 -177.407 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -93.75 -21.42 19.33 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 69.03 42.5 1.26 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.268 0.556 . . . . 0.0 109.825 -177.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -152.27 165.1 35.95 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.144 -177.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.456 ' CB ' HD12 ' B' 1338 ' ' LEU . 85.8 m95 -93.88 141.42 28.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.357 177.443 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -125.03 126.48 45.47 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 176.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -72.86 141.05 47.95 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 177.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 63.3 p -92.19 177.38 6.17 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.254 -178.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -87.09 14.19 8.0 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 45.2 t -109.28 106.37 20.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 120.966 0.412 . . . . 0.0 110.366 179.409 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -129.91 111.9 13.01 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 173.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.71 176.49 39.01 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 120.192 -1.004 . . . . 0.0 112.176 -168.181 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.483 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.09 135.43 37.71 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 174.789 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -100.42 128.26 46.53 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 -176.3 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.483 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.0 m-85 -131.56 143.04 50.08 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.249 177.257 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.638 HD11 HG23 ' A' ' 116' ' ' ILE . 69.6 mt -101.54 127.78 54.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 172.211 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.672 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.8 m-30 -108.48 137.35 46.58 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.984 0.421 . . . . 0.0 111.298 -175.149 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 30.5 t60 -117.78 143.25 46.41 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.173 175.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 62.6 ttt180 -142.03 148.37 38.36 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.093 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -86.95 28.15 0.94 Allowed 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.95 164.76 36.52 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.011 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -64.01 129.47 93.94 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-O 118.491 -0.766 . . . . 0.0 110.012 -177.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.93 140.87 69.71 Favored 'Cis proline' 0 N--CA 1.497 1.71 0 CA-C-N 121.804 1.68 . . . . 0.0 111.693 -1.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -65.61 -44.72 85.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.007 -177.498 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -142.79 137.37 29.66 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.442 0.639 . . . . 0.0 110.924 -176.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.4 t -150.61 152.3 33.85 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.326 -177.382 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.432 HG13 HD11 ' A' ' 80' ' ' ILE . 46.1 mt -110.86 138.54 38.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -179.147 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -131.87 141.93 49.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.066 -176.76 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.1 mt -123.06 133.25 69.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.218 0.532 . . . . 0.0 109.872 172.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -100.77 99.56 10.11 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.553 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.2 t-20 -71.53 108.58 4.99 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 123.716 0.635 . . . . 0.0 111.023 -175.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -74.82 -38.37 62.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.405 -171.604 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 67.0 mt -72.9 -45.17 59.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.46 -175.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 49.5 m-20 -95.12 -3.08 48.67 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -175.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.9 p 51.34 42.39 29.07 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.507 0.67 . . . . 0.0 111.03 178.37 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 40.9 m -127.44 149.07 50.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.812 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.728 ' CB ' HG21 ' A' ' 17' ' ' ILE . 52.7 p -101.86 144.77 30.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.896 0.379 . . . . 0.0 111.292 -177.549 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -138.6 122.25 17.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.189 177.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.7 p -125.55 148.93 30.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.074 -178.442 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 48.3 tt0 -147.9 136.61 11.5 Favored Pre-proline 0 CA--C 1.537 0.48 0 CA-C-O 119.059 -0.496 . . . . 0.0 110.597 175.344 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -75.31 150.89 37.5 Favored 'Trans proline' 0 N--CA 1.497 1.733 0 C-N-CA 121.673 1.582 . . . . 0.0 112.435 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.432 HD11 HG13 ' A' ' 65' ' ' ILE . 65.2 mt -90.59 123.69 42.87 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-O 120.935 0.398 . . . . 0.0 110.382 178.34 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.0 p -99.15 160.88 13.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.003 176.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -98.23 6.03 61.37 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 120.972 -0.632 . . . . 0.0 113.683 -177.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 62.7 m -100.34 -0.96 37.33 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.035 0.917 . . . . 0.0 113.034 177.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.1 mt -69.23 139.92 54.5 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-N 118.105 0.412 . . . . 0.0 111.411 -177.454 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.7 tt0 -111.43 135.82 51.45 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.539 174.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 74.4 mt -112.99 156.91 22.22 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.149 0.499 . . . . 0.0 111.371 -175.193 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -142.09 140.0 32.4 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.7 t -104.83 109.1 20.92 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.982 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -106.94 103.69 48.59 Favored Pre-proline 0 C--N 1.329 -0.297 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 170.118 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.1 141.49 48.06 Favored 'Trans proline' 0 N--CA 1.497 1.685 0 CA-C-N 120.627 1.26 . . . . 0.0 111.833 -172.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -90.54 11.74 57.89 Favored 'Cis proline' 0 N--CA 1.498 1.773 0 CA-C-N 121.154 1.448 . . . . 0.0 113.699 -3.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -91.3 170.7 9.77 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.544 0.211 . . . . 0.0 110.806 -177.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 47.4 tp -120.8 135.96 55.02 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 173.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.473 HD11 ' CG2' ' A' ' 102' ' ' ILE . 9.3 tp -127.14 140.02 52.55 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -175.767 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -143.77 155.91 44.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.878 0.371 . . . . 0.0 110.602 175.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 27.5 mtm105 -101.9 146.62 27.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.723 -178.267 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -128.07 163.75 23.91 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.722 0.772 . . . . 0.0 111.385 -177.456 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -47.31 146.17 2.06 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.227 -177.518 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 25.1 mmt85 65.12 30.9 11.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.173 -0.922 . . . . 0.0 112.136 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.6 m 66.36 35.17 5.9 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.898 0.38 . . . . 0.0 111.616 166.024 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -99.35 150.06 22.52 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.027 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.473 ' CG2' HD11 ' A' ' 94' ' ' LEU . 77.8 mt -114.47 127.76 71.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 121.076 0.465 . . . . 0.0 109.774 -178.814 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 90.3 mtt180 -137.24 145.91 44.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.412 178.489 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.85 169.35 25.29 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -125.29 138.77 54.09 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.783 0.325 . . . . 0.0 110.909 -178.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 77.8 t90 -104.09 126.74 51.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.517 175.083 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.449 ' CD1' HG22 ' A' ' 31' ' ' VAL . 68.6 m-85 -115.6 141.37 48.16 Favored 'General case' 0 C--N 1.33 -0.276 0 O-C-N 123.244 0.34 . . . . 0.0 110.563 -179.203 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -50.68 -37.96 44.08 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.785 178.733 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -133.52 137.29 45.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.305 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.2 t -62.21 -42.36 99.22 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.127 -178.173 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -59.32 -44.29 92.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.425 0.631 . . . . 0.0 110.043 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -56.78 -44.05 81.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.088 178.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 51.8 t -58.93 -39.01 80.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.551 177.08 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -59.09 -46.19 88.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.8 0.333 . . . . 0.0 110.566 -177.017 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.9 mtm105 -61.4 -49.92 74.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.745 -177.223 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.638 HG23 HD11 ' A' ' 54' ' ' ILE . 28.1 mm -58.54 -43.88 88.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.033 0.444 . . . . 0.0 109.955 -178.55 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 57.3 p -59.81 -44.25 94.1 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.674 -177.484 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.54 -43.91 93.99 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 -178.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.496 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.5 mt -58.8 -48.67 80.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.142 0.496 . . . . 0.0 110.508 -178.668 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 54.7 t -59.0 -42.85 87.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.146 -178.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -57.36 -42.66 82.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.915 0.388 . . . . 0.0 110.566 -178.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.68 -43.54 99.12 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.243 -0.743 . . . . 0.0 111.243 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.7 mt -60.76 -42.2 96.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.801 0.334 . . . . 0.0 110.832 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 81.0 mt . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.139 -177.928 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B 1338 ' ' LEU . . . . . 0.456 HD12 ' CB ' ' A' ' 43' ' ' TRP . 14.6 mt . . . . . 0 CA--C 1.53 0.203 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -79.14 139.7 15.18 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 C-N-CA 121.177 1.252 . . . . 0.0 111.366 174.596 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -97.17 125.94 43.95 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-O 118.463 -0.78 . . . . 0.0 109.628 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo -78.1 161.58 29.4 Favored 'Trans proline' 0 N--CA 1.496 1.656 0 C-N-CA 121.187 1.258 . . . . 0.0 111.929 178.281 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -49.91 157.0 2.94 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 C-N-CA 121.345 1.363 . . . . 0.0 111.838 177.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 81.2 mt -49.98 -23.56 2.08 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -177.373 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -58.33 -36.34 73.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.702 0.286 . . . . 0.0 111.497 -176.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B 1345 ' ' TRP . . . . . 0.444 ' CH2' HD13 ' A' ' 102' ' ' ILE . 49.1 t90 -65.06 -48.4 73.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.685 -0.234 . . . . 0.0 111.061 -173.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -70.84 -40.13 72.56 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.881 -176.826 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -61.05 -46.27 91.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.858 0.361 . . . . 0.0 110.578 -179.229 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -59.83 -47.75 84.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.616 -176.635 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.07 -47.79 83.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.981 0.419 . . . . 0.0 110.773 -177.187 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.319 -175.307 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.5 m . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.876 0.37 . . . . 0.0 110.571 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.9 mm -60.34 -45.11 96.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.133 -178.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.3 m -59.21 -44.75 92.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.924 0.392 . . . . 0.0 110.561 -177.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -60.12 -45.64 92.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.482 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 66.2 mtt -58.13 -42.43 85.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.992 0.425 . . . . 0.0 110.457 -178.239 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -60.93 -50.52 73.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.251 -178.715 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.739 ' HA ' HD12 ' A' ' 14' ' ' ILE . 13.1 tp -59.84 -30.34 68.88 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.794 -0.363 . . . . 0.0 111.32 -179.369 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.3 -51.99 60.72 Favored 'General case' 0 C--N 1.332 -0.153 0 O-C-N 122.161 -0.337 . . . . 0.0 110.754 178.53 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.65 -40.83 80.17 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.027 0.441 . . . . 0.0 110.553 179.014 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.739 HD12 ' HA ' ' A' ' 11' ' ' LEU . 93.9 mt -54.12 -53.01 31.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.608 178.716 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -51.9 -25.19 7.52 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -178.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -59.26 -34.37 72.16 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -177.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.5 mm -106.53 -44.79 7.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.112 0.482 . . . . 0.0 109.938 -177.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -117.2 77.49 9.57 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.628 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -55.05 -20.66 24.3 Favored 'Trans proline' 0 N--CA 1.497 1.704 0 C-N-CA 121.491 1.461 . . . . 0.0 113.631 -174.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.3 p90 -89.03 2.06 54.61 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -174.21 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -78.59 130.23 35.69 Favored 'General case' 0 C--O 1.231 0.093 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 175.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -108.84 -39.25 5.39 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.025 -174.287 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.3 tt0 -131.63 146.03 51.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.995 0.426 . . . . 0.0 111.137 -175.298 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.467 HG13 HD13 ' A' ' 11' ' ' LEU . 58.7 mt -100.54 132.07 46.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.681 172.395 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.1 t -91.59 -47.12 14.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.098 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.516 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -157.22 157.51 34.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.953 178.871 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 64.2 p -143.64 132.24 22.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.119 0.485 . . . . 0.0 111.234 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.6 t -107.05 126.59 52.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.551 176.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.6 m -54.54 -38.87 67.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.313 -172.003 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -149.81 126.6 11.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.119 0.485 . . . . 0.0 111.68 -178.076 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.424 HG21 ' HB3' ' A' ' 52' ' ' PHE . 93.8 t -145.22 140.53 22.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.09 -0.959 . . . . 0.0 109.531 -177.866 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.56 149.84 51.15 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.684 0.278 . . . . 0.0 111.203 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.527 ' CD2' HG21 ' A' ' 46' ' ' THR . 14.2 t80 -98.5 131.03 45.07 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.365 0.602 . . . . 0.0 111.798 -176.251 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -127.5 140.41 52.16 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.199 177.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.3 m -121.66 145.49 47.95 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.283 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -109.15 131.0 55.48 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.913 0.387 . . . . 0.0 110.344 177.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -101.94 115.21 30.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.835 176.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 85.4 p -68.71 -31.35 70.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.998 -0.547 . . . . 0.0 112.015 -177.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.1 m -62.44 -37.81 87.32 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.652 0.263 . . . . 0.0 111.076 -178.092 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -95.59 -21.45 18.23 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -178.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 54.8 t30 69.4 46.08 0.79 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.524 0.678 . . . . 0.0 109.425 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 74.5 tt0 -155.06 151.46 28.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.058 -177.407 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.425 ' CB ' HD12 ' B' 1338 ' ' LEU . 85.6 m95 -88.18 141.85 28.23 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.307 176.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -121.93 129.01 52.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.881 176.21 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -74.53 136.92 42.15 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 178.229 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.527 HG21 ' CD2' ' A' ' 33' ' ' PHE . 71.5 p -92.3 169.88 10.24 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.188 -178.687 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.4 p-10 -83.12 11.13 6.78 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.8 t -101.62 106.47 19.7 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-O 120.934 0.397 . . . . 0.0 110.287 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -131.51 111.37 11.71 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 175.213 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.63 176.57 38.94 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.015 -1.088 . . . . 0.0 112.307 -168.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.485 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -80.6 134.9 35.97 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 174.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.424 ' HB3' HG21 ' A' ' 31' ' ' VAL . 5.4 t80 -99.21 128.37 45.33 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 -176.178 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.485 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.2 m-85 -132.52 143.05 49.48 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.341 177.418 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.649 HD11 HG23 ' A' ' 116' ' ' ILE . 68.9 mt -101.59 127.71 54.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 172.532 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.66 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 15.3 m-30 -108.44 138.29 44.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.845 0.355 . . . . 0.0 111.608 -176.006 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 64.1 t60 -114.66 143.37 45.14 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.283 174.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 29.3 ttp180 -141.46 152.35 44.15 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.481 177.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -86.95 28.19 0.93 Allowed 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.844 -0.617 . . . . 0.0 112.14 -178.448 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -155.45 152.15 28.64 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -63.98 133.51 95.61 Favored Pre-proline 0 CA--C 1.541 0.598 0 CA-C-O 118.456 -0.783 . . . . 0.0 110.323 -176.264 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -68.29 140.85 57.98 Favored 'Cis proline' 0 N--CA 1.498 1.746 0 CA-C-N 121.672 1.633 . . . . 0.0 111.409 -0.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -66.61 -38.78 87.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.253 -176.371 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -141.44 141.11 33.72 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.683 0.754 . . . . 0.0 111.122 -176.042 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.6 t -149.8 151.31 33.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.912 -178.067 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 50.4 mt -109.82 140.46 28.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.456 ' HD1' HG22 ' A' ' 77' ' ' VAL . 64.9 t80 -131.79 142.11 49.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.578 -177.446 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 58.9 mt -123.49 128.62 74.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.186 0.517 . . . . 0.0 109.894 172.15 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -94.07 99.54 11.82 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.171 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -75.45 106.85 7.2 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.65 0.594 . . . . 0.0 111.045 -174.662 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.413 HH21 ' HB2' ' A' ' 51' ' ' ALA . 98.6 mtt180 -72.45 -43.49 63.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.565 -171.572 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 67.3 mt -70.8 -45.17 65.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.731 -174.487 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 37.2 m-20 -95.09 -3.29 48.38 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -175.562 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.3 p 50.35 42.29 25.76 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.511 0.672 . . . . 0.0 111.257 177.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.5 m -127.16 145.93 50.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.232 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 97.5 p -88.24 132.64 34.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.248 -178.567 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -123.07 122.26 38.05 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 174.357 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.456 HG22 ' HD1' ' A' ' 66' ' ' PHE . 26.3 t -125.42 148.0 30.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 120.764 0.316 . . . . 0.0 110.946 -175.042 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -148.73 126.48 5.73 Favored Pre-proline 0 CA--C 1.539 0.552 0 CA-C-O 118.678 -0.677 . . . . 0.0 110.495 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -75.49 151.0 36.87 Favored 'Trans proline' 0 N--CA 1.499 1.836 0 C-N-CA 121.408 1.405 . . . . 0.0 112.05 177.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 70.3 mt -91.44 112.29 25.18 Favored 'Isoleucine or valine' 0 C--O 1.231 0.125 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.472 179.599 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 66.0 p -98.94 153.34 18.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.842 175.563 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -96.59 32.5 6.47 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.355 -178.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.0 m -111.05 -19.13 12.86 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 173.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.9 mt -68.81 145.69 53.53 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.914 0.388 . . . . 0.0 111.452 -175.56 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 54.8 tt0 -111.76 136.12 51.46 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.819 175.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.439 HD12 ' ND2' ' A' ' 121' ' ' ASN . 64.2 mt -110.97 158.64 18.55 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.709 -177.219 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -149.52 142.95 25.3 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.292 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.1 t -100.38 109.18 21.34 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.476 179.043 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 23.7 mm-40 -106.61 103.67 47.52 Favored Pre-proline 0 C--N 1.329 -0.296 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 173.033 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -67.5 141.15 54.64 Favored 'Trans proline' 0 N--CA 1.497 1.724 0 CA-C-N 120.512 1.219 . . . . 0.0 111.919 -171.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -90.6 11.14 59.37 Favored 'Cis proline' 0 N--CA 1.499 1.818 0 CA-C-N 121.173 1.455 . . . . 0.0 113.667 -5.215 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -92.3 170.33 9.88 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.516 0.326 . . . . 0.0 110.67 -176.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 56.2 tp -115.59 134.48 55.02 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 173.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 12.0 tp -127.58 140.23 52.25 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 -173.631 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -148.17 155.52 41.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.849 0.357 . . . . 0.0 110.477 175.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.2 mtm105 -104.71 147.97 27.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.947 -176.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -128.67 167.34 17.36 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.944 0.878 . . . . 0.0 111.339 -178.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -47.77 148.48 1.55 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.195 -0.912 . . . . 0.0 112.188 -177.301 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 62.82 30.96 16.65 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.134 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.2 p 65.34 35.33 7.61 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.758 0.313 . . . . 0.0 111.638 166.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 68.5 mtp180 -98.0 147.21 24.73 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 76.9 mt -111.65 127.05 69.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 -177.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -134.26 147.96 50.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.451 -179.117 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.39 166.43 26.81 Favored Glycine 0 CA--C 1.524 0.652 0 C-N-CA 120.901 -0.666 . . . . 0.0 111.621 -178.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -125.27 140.78 52.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.24 -0.48 . . . . 0.0 110.213 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 83.9 t90 -107.42 128.98 54.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.652 175.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -115.46 144.24 44.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.806 0.336 . . . . 0.0 110.76 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -52.1 -35.92 49.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.568 177.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -135.44 135.69 40.75 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.814 0.34 . . . . 0.0 110.487 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.7 t -62.58 -42.32 99.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.188 -177.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -59.44 -43.88 93.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.412 0.625 . . . . 0.0 110.099 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -56.42 -45.55 80.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.077 179.181 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 41.3 t -60.47 -38.59 84.71 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.858 178.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -59.14 -45.57 90.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.829 0.347 . . . . 0.0 110.488 -177.273 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 -60.58 -48.52 81.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.574 -178.157 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.649 HG23 HD11 ' A' ' 54' ' ' ILE . 28.5 mm -58.24 -44.94 89.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.044 0.45 . . . . 0.0 109.982 -178.897 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 57.8 p -59.35 -44.01 92.73 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.692 -177.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.62 -43.96 94.11 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.516 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.7 mt -58.74 -48.6 80.62 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.136 0.493 . . . . 0.0 110.502 -178.721 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 48.9 t -58.73 -44.12 89.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.141 -178.053 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.439 ' ND2' HD12 ' A' ' 86' ' ' LEU . 31.3 m120 -58.51 -41.9 86.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.828 -178.543 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.58 -42.94 99.64 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 111.411 -0.676 . . . . 0.0 111.411 -178.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 47.5 mt -63.29 -43.0 99.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.801 0.334 . . . . 0.0 111.172 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 25.4 mt . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.591 -176.884 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B 1338 ' ' LEU . . . . . 0.425 HD12 ' CB ' ' A' ' 43' ' ' TRP . 26.6 mt . . . . . 0 CA--C 1.532 0.256 0 CA-C-O 118.425 -0.797 . . . . 0.0 109.736 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -79.14 139.61 15.12 Favored 'Trans proline' 0 N--CA 1.494 1.532 0 CA-C-N 120.401 1.179 . . . . 0.0 111.16 174.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 26.3 mtmt -97.26 125.97 43.63 Favored Pre-proline 0 CA--C 1.535 0.384 0 CA-C-O 118.462 -0.78 . . . . 0.0 110.35 178.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -63.64 162.33 28.48 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 CA-C-N 120.697 1.284 . . . . 0.0 111.515 176.26 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -49.82 156.68 3.09 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 121.316 1.344 . . . . 0.0 111.739 178.562 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 82.0 mt -50.04 -28.81 7.6 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -176.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 64.0 t80 -55.69 -37.56 68.51 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.814 0.34 . . . . 0.0 111.205 -177.05 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 52.9 t90 -60.96 -48.13 83.26 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.425 -176.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -63.64 -48.89 75.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.035 0.445 . . . . 0.0 110.618 -178.009 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.29 -42.42 91.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.017 -176.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -59.37 -49.39 77.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.88 0.371 . . . . 0.0 110.592 -176.21 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.21 -49.44 77.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.771 -177.417 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.331 -175.742 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.8 m . . . . . 0 CA--C 1.526 0.044 0 CA-C-O 120.932 0.396 . . . . 0.0 110.809 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.3 mm -60.67 -47.72 91.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.13 -178.257 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.7 m -58.45 -43.43 88.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.466 -177.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -60.02 -45.76 91.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.644 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 89.7 mtp -58.21 -43.06 87.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.04 0.448 . . . . 0.0 110.448 -178.264 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -60.69 -50.16 74.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.298 -178.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.729 ' HA ' HD12 ' A' ' 14' ' ' ILE . 14.1 tp -60.66 -30.77 70.1 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.276 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.15 -50.7 69.38 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 122.276 -0.265 . . . . 0.0 110.601 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.97 -41.67 83.43 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.001 0.429 . . . . 0.0 110.424 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.729 HD12 ' HA ' ' A' ' 11' ' ' LEU . 94.4 mt -54.23 -52.94 33.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.594 178.891 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -53.95 -24.38 16.3 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.223 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -59.25 -33.22 70.76 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.0 mm -107.9 -42.09 5.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.765 0.317 . . . . 0.0 110.298 -177.057 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 35.9 t0 -115.11 85.47 12.42 Favored Pre-proline 0 CA--C 1.533 0.323 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.709 -175.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -53.75 -24.4 30.28 Favored 'Trans proline' 0 N--CA 1.497 1.709 0 C-N-CA 121.421 1.414 . . . . 0.0 113.319 -177.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.6 p90 -95.5 19.56 10.81 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 -175.241 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -101.94 118.21 36.43 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 172.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.45 ' O ' HD21 ' A' ' 11' ' ' LEU . 70.3 mmtt -112.98 -33.51 6.03 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -173.386 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -127.91 142.47 51.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.842 0.354 . . . . 0.0 110.684 -178.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.478 HG13 HD13 ' A' ' 11' ' ' LEU . 57.8 mt -99.43 129.78 49.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.827 173.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.9 t -90.57 -47.23 14.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.268 -0.423 . . . . 0.0 109.943 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.489 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.9 t0 -154.37 154.42 33.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.991 178.425 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 58.7 p -142.29 131.95 24.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.045 0.45 . . . . 0.0 111.009 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 38.5 t -107.58 126.61 52.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.682 177.151 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 86.7 p -54.59 -38.05 66.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.232 -172.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 61.0 t-80 -151.15 126.06 9.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.256 0.55 . . . . 0.0 111.523 -179.106 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.44 HG22 ' CD2' ' A' ' 107' ' ' PHE . 99.6 t -144.86 142.18 23.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.44 -178.018 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -130.53 149.76 52.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.09 -178.157 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.575 ' CD2' HG21 ' A' ' 46' ' ' THR . 13.7 t80 -97.12 131.02 44.3 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.275 0.559 . . . . 0.0 111.588 -177.401 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.422 ' CD1' HD11 ' B' 1338 ' ' LEU . 34.5 m-85 -124.42 141.18 52.28 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.585 178.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 92.2 m -122.34 145.08 48.59 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 177.389 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -108.03 130.45 55.07 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 120.893 0.378 . . . . 0.0 110.313 177.033 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -101.29 114.86 29.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.784 176.354 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 27.1 m -67.49 -32.94 74.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.842 -177.076 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.0 m -61.47 -38.41 87.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.635 0.255 . . . . 0.0 111.006 -177.399 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -94.58 -21.5 18.8 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -178.564 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 25.8 t30 68.81 45.53 0.99 Allowed 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.426 0.631 . . . . 0.0 109.438 -177.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 78.2 tt0 -154.05 150.95 28.76 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.083 -176.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.416 ' CB ' HD12 ' B' 1338 ' ' LEU . 89.4 m95 -86.51 142.02 28.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.255 176.856 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -125.04 134.09 52.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.34 -0.391 . . . . 0.0 109.99 176.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -75.53 140.95 43.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.287 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.575 HG21 ' CD2' ' A' ' 33' ' ' PHE . 62.6 p -92.39 172.36 8.44 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.066 178.747 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -83.86 12.61 5.84 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.9 t -108.41 106.49 20.79 Favored 'Isoleucine or valine' 0 C--O 1.231 0.123 0 CA-C-O 121.067 0.46 . . . . 0.0 110.43 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -129.96 112.63 13.69 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 173.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.61 176.49 38.93 Favored Glycine 0 CA--C 1.52 0.391 0 C-N-CA 120.192 -1.004 . . . . 0.0 112.354 -168.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.5 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.75 134.79 37.02 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 175.226 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -100.04 126.9 46.31 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.146 -175.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.5 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 7.3 m-85 -131.52 142.16 49.89 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.767 0.318 . . . . 0.0 110.537 177.059 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.621 HD11 HG23 ' A' ' 116' ' ' ILE . 67.7 mt -101.68 126.72 55.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 172.35 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.685 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 14.0 m-30 -108.46 137.69 46.01 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.826 0.346 . . . . 0.0 111.343 -176.413 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 58.1 t60 -114.11 143.29 45.03 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.368 175.19 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.8 tpt180 -142.09 147.53 36.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.427 175.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.8 m120 -86.79 28.17 0.92 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.25 171.32 20.41 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -63.98 124.75 86.2 Favored Pre-proline 0 CA--C 1.539 0.535 0 CA-C-O 118.439 -0.791 . . . . 0.0 110.021 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -78.73 140.93 61.65 Favored 'Cis proline' 0 N--CA 1.498 1.746 0 CA-C-N 121.994 1.748 . . . . 0.0 111.906 -0.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -63.83 -46.53 84.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.096 -177.415 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.465 ' HB3' HD12 ' A' ' 80' ' ' ILE . 77.0 m80 -143.15 138.66 29.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.341 0.591 . . . . 0.0 110.992 -176.778 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.6 t -150.18 152.06 34.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.37 -178.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.426 HG13 HD11 ' A' ' 80' ' ' ILE . 50.8 mt -114.48 137.14 48.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 -178.148 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -131.91 142.19 49.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.537 -176.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 62.2 mt -120.4 129.93 75.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.2 0.524 . . . . 0.0 109.706 172.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -96.13 99.55 11.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.981 -1.009 . . . . 0.0 109.322 179.422 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.3 t-20 -71.79 106.28 4.09 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 123.669 0.605 . . . . 0.0 111.062 -174.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -74.01 -40.07 63.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.252 -171.314 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 72.9 mt -72.05 -45.19 61.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.648 -174.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 60.9 m-20 -95.11 -3.32 48.25 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 -175.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.437 ' O ' HG22 ' A' ' 73' ' ' THR . 13.3 m 55.6 43.18 28.66 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-O 121.493 0.663 . . . . 0.0 110.561 177.716 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.6 m -127.52 148.9 50.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.56 -177.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.9 p -99.2 135.36 40.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.322 -179.69 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -131.91 122.23 25.3 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.673 0.273 . . . . 0.0 110.266 175.446 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.7 p -125.54 149.88 30.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.094 -177.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 26.4 tp10 -147.36 133.95 9.88 Favored Pre-proline 0 CA--C 1.538 0.509 0 CA-C-O 118.861 -0.59 . . . . 0.0 110.302 174.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.42 150.94 37.1 Favored 'Trans proline' 0 N--CA 1.498 1.765 0 C-N-CA 121.54 1.494 . . . . 0.0 112.301 179.029 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.465 HD12 ' HB3' ' A' ' 63' ' ' HIS . 63.7 mt -89.47 139.5 17.36 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.19 177.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.1 p -132.09 156.88 45.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.867 177.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -98.16 37.71 3.37 Favored Glycine 0 CA--C 1.524 0.6 0 C-N-CA 121.0 -0.619 . . . . 0.0 111.832 -178.603 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 51.6 p -111.07 -23.19 11.06 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 174.363 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.8 mt -69.09 145.82 53.1 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.977 0.418 . . . . 0.0 111.502 -175.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 57.0 tt0 -113.66 135.92 53.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.556 175.08 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 68.9 mt -111.12 160.0 17.31 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.99 0.424 . . . . 0.0 110.978 -175.687 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -149.52 140.76 23.12 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.219 -0.659 . . . . 0.0 109.219 178.188 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.5 t -99.12 109.19 21.93 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.871 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -106.8 103.81 48.7 Favored Pre-proline 0 C--N 1.329 -0.307 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 172.36 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -71.67 139.87 34.77 Favored 'Trans proline' 0 N--CA 1.497 1.708 0 CA-C-N 120.501 1.215 . . . . 0.0 112.047 -171.007 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -88.99 9.49 64.49 Favored 'Cis proline' 0 N--CA 1.501 1.926 0 CA-C-N 121.22 1.471 . . . . 0.0 113.684 -4.128 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -84.61 170.41 13.4 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.775 0.321 . . . . 0.0 110.986 -177.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.1 tp -118.84 133.34 55.9 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 170.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.421 HD11 ' CG2' ' A' ' 102' ' ' ILE . 10.9 tp -126.01 141.01 52.14 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.538 0.209 . . . . 0.0 110.499 -174.409 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 15.3 p90 -147.4 156.37 42.82 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.799 0.333 . . . . 0.0 110.382 176.276 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.7 mtm105 -101.93 144.24 30.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.97 0.414 . . . . 0.0 110.734 -178.039 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -124.95 162.84 23.59 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.738 0.78 . . . . 0.0 111.446 -176.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -47.75 146.21 2.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.164 -177.102 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 65.36 30.92 10.81 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.067 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 43.1 t 66.17 35.19 6.24 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.863 0.363 . . . . 0.0 111.7 164.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.9 mtt-85 -102.93 152.76 20.94 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.469 HD13 ' CH2' ' B' 1345 ' ' TRP . 81.4 mt -111.99 127.75 68.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-O 121.075 0.464 . . . . 0.0 109.813 -176.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 80.4 mtt180 -130.25 147.13 51.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.463 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -142.61 166.29 26.56 Favored Glycine 0 CA--C 1.523 0.537 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 -178.171 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -126.05 140.84 52.27 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.742 0.306 . . . . 0.0 110.749 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 13.5 t90 -108.5 128.27 54.65 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.608 175.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.44 ' CD2' HG22 ' A' ' 31' ' ' VAL . 58.3 m-85 -117.54 144.22 45.32 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.769 0.319 . . . . 0.0 110.631 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -52.4 -36.79 54.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.582 178.212 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 39.1 t-20 -134.01 135.05 43.15 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.757 0.313 . . . . 0.0 110.511 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.3 p -61.92 -41.39 97.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.172 -177.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -60.69 -43.18 98.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.421 0.629 . . . . 0.0 110.159 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -56.53 -45.31 81.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.579 0.704 . . . . 0.0 109.99 178.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 42.1 t -60.01 -39.27 85.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.705 178.02 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -58.72 -44.91 90.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.907 0.384 . . . . 0.0 110.545 -177.446 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -60.25 -48.77 80.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.593 -177.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.621 HG23 HD11 ' A' ' 54' ' ' ILE . 31.0 mm -58.51 -45.45 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.064 0.459 . . . . 0.0 109.979 -178.538 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.5 p -59.7 -43.78 93.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.733 -177.493 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.72 -43.79 94.36 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 -178.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.489 HD13 ' HB2' ' A' ' 26' ' ' ASP . 10.3 mt -59.15 -48.92 79.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.054 0.454 . . . . 0.0 110.616 -178.167 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 58.7 t -59.21 -43.13 88.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.056 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 27.3 m120 -57.54 -42.55 83.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.6 -178.391 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.79 -45.44 96.21 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 -179.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 27.4 mt -58.56 -42.21 87.4 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.876 0.37 . . . . 0.0 110.594 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 80.6 mt . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.638 179.27 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B 1338 ' ' LEU . . . . . 0.422 HD11 ' CD1' ' A' ' 34' ' ' TYR . 12.0 mt . . . . . 0 CA--C 1.531 0.231 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.1 139.74 15.28 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 C-N-CA 121.09 1.193 . . . . 0.0 111.257 175.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 12.1 mmmt -97.13 125.74 44.74 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-O 118.783 -0.627 . . . . 0.0 110.011 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -74.2 155.22 46.91 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 121.396 1.397 . . . . 0.0 111.565 172.341 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -50.66 157.02 3.83 Favored 'Trans proline' 0 N--CA 1.495 1.569 0 C-N-CA 121.236 1.291 . . . . 0.0 111.721 178.464 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 82.4 mt -50.04 -26.93 4.84 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.192 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 57.1 t80 -55.15 -38.13 67.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.892 0.377 . . . . 0.0 111.086 -177.488 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B 1345 ' ' TRP . . . . . 0.469 ' CH2' HD13 ' A' ' 102' ' ' ILE . 46.3 t90 -61.12 -48.04 83.49 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.298 -177.651 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -60.07 -46.87 88.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.97 0.414 . . . . 0.0 110.421 -177.558 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -60.41 -43.75 96.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.955 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -59.14 -45.59 90.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.773 -177.402 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -62.59 -52.91 61.54 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.858 -176.189 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 19.0 pt20 . . . . . 0 C--N 1.327 -0.375 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.482 -176.082 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.8 t . . . . . 0 C--O 1.23 0.029 0 CA-C-O 121.043 0.449 . . . . 0.0 110.507 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.4 mm -59.69 -44.53 93.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.18 -178.797 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.3 m -59.48 -44.97 92.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.449 -177.585 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -59.55 -45.27 92.31 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.52 -178.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 88.5 mtp -58.22 -43.68 87.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.02 0.438 . . . . 0.0 110.421 -178.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -60.32 -49.22 78.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.269 -178.537 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.608 ' HA ' HD12 ' A' ' 14' ' ' ILE . 10.7 tp -59.16 -33.85 71.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.972 -179.092 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.37 -50.54 69.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.546 0.212 . . . . 0.0 110.875 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.01 -42.13 84.57 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.976 0.417 . . . . 0.0 110.441 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.608 HD12 ' HA ' ' A' ' 11' ' ' LEU . 94.8 mt -54.22 -52.92 33.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.7 178.33 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -51.54 -25.13 6.15 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -178.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.5 tptp -57.84 -35.52 71.02 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.603 0.24 . . . . 0.0 111.469 -178.032 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.3 mm -103.92 -47.88 10.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.119 0.485 . . . . 0.0 109.792 -178.288 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -117.57 79.18 12.16 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.043 -176.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -54.72 -20.59 22.31 Favored 'Trans proline' 0 N--CA 1.498 1.746 0 C-N-CA 121.545 1.497 . . . . 0.0 113.695 -175.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 19.5 p90 -90.41 5.45 47.45 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -174.081 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -80.72 125.12 29.65 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 173.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.581 ' O ' HD21 ' A' ' 11' ' ' LEU . 79.7 tttt -104.59 -39.51 6.35 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.814 -0.354 . . . . 0.0 111.124 -172.781 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -134.41 146.33 49.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.956 0.408 . . . . 0.0 111.27 -175.579 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.444 HD11 HD12 ' A' ' 14' ' ' ILE . 21.1 mt -100.87 133.65 43.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 172.024 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.7 t -92.39 -47.19 14.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.936 179.21 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.516 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -152.07 154.18 35.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.068 178.777 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.4 p -141.82 132.02 24.87 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.01 0.433 . . . . 0.0 110.748 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.7 t -107.4 128.98 54.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.737 176.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 87.3 p -54.58 -37.87 66.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.302 -172.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -152.74 127.34 9.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.231 0.539 . . . . 0.0 111.702 -178.723 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.402 HG21 ' HB3' ' A' ' 52' ' ' PHE . 97.5 t -145.27 141.82 22.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 114.97 -1.014 . . . . 0.0 109.521 -177.737 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.92 149.9 51.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.041 -178.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.514 ' HD1' HG21 ' A' ' 46' ' ' THR . 27.1 t80 -100.72 131.64 46.51 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.278 0.561 . . . . 0.0 111.597 -177.005 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -126.5 144.73 50.77 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.826 179.339 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 84.2 m -122.71 147.94 45.89 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 177.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -108.84 132.0 54.44 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.983 0.421 . . . . 0.0 110.379 176.192 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.9 t-20 -104.1 114.76 29.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.779 177.006 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.9 m -67.7 -32.71 73.54 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.969 -176.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.0 t -60.37 -39.71 88.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.757 0.313 . . . . 0.0 110.904 -177.178 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -94.09 -21.41 19.14 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 69.37 43.97 0.99 Allowed 'General case' 0 C--O 1.232 0.139 0 CA-C-O 121.419 0.628 . . . . 0.0 109.703 -177.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -150.02 163.46 38.08 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.165 -177.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -96.43 139.77 32.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.25 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -123.69 130.28 52.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.083 176.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -75.27 142.48 43.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.0 178.419 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.514 HG21 ' HD1' ' A' ' 33' ' ' PHE . 72.9 p -92.33 177.21 6.21 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.719 -0.393 . . . . 0.0 110.07 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -86.93 13.6 8.79 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.4 t -109.48 106.39 20.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 120.928 0.394 . . . . 0.0 110.619 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -129.95 111.55 12.65 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 173.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.64 176.51 38.95 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 120.261 -0.971 . . . . 0.0 112.256 -168.302 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.473 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.53 136.72 37.63 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 175.201 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.402 ' HB3' HG21 ' A' ' 31' ' ' VAL . 4.3 t80 -101.64 126.16 48.43 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.27 -175.637 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.473 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 5.8 m-85 -129.88 142.25 50.69 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.817 0.341 . . . . 0.0 110.402 177.055 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.655 HD11 HG23 ' A' ' 116' ' ' ILE . 67.5 mt -101.61 127.02 55.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 172.188 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.593 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.1 m-30 -108.55 139.66 43.01 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.929 0.395 . . . . 0.0 111.516 -176.032 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -113.13 143.34 44.52 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.014 174.013 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 30.0 ttp180 -141.13 152.86 45.06 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.59 178.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -86.89 28.11 0.93 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.164 -178.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -155.3 152.35 29.1 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -63.98 133.78 95.71 Favored Pre-proline 0 CA--C 1.541 0.598 0 CA-C-O 118.49 -0.767 . . . . 0.0 110.252 -176.375 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -68.35 140.91 58.55 Favored 'Cis proline' 0 N--CA 1.499 1.797 0 CA-C-N 121.702 1.644 . . . . 0.0 111.437 -1.079 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -63.64 -38.72 92.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.189 -177.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -141.06 141.85 34.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.611 0.719 . . . . 0.0 111.086 -176.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.2 t -149.54 152.16 35.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.922 -178.314 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.465 HG13 HD11 ' A' ' 80' ' ' ILE . 54.0 mt -113.03 138.66 41.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 -177.055 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -131.79 142.09 49.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.146 -177.705 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.1 mt -121.11 130.55 74.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-O 121.275 0.559 . . . . 0.0 109.815 172.288 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -96.44 99.58 11.23 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.269 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.7 t-20 -72.16 107.12 4.66 Favored 'General case' 0 C--N 1.332 -0.176 0 O-C-N 123.58 0.55 . . . . 0.0 111.192 -174.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.6 mtm105 -74.51 -39.8 62.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.387 -171.25 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 56.7 mt -74.2 -45.17 50.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.475 -175.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 39.4 t-20 -95.05 -3.23 48.63 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -175.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 63.3 p 51.52 42.54 29.53 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.479 0.656 . . . . 0.0 110.959 178.262 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.6 m -124.37 148.92 47.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.201 -179.315 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 11.2 p -98.97 134.7 41.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.281 -178.384 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -131.39 122.15 25.83 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.33 175.6 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.5 p -125.58 149.76 30.49 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.008 -178.635 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -149.04 132.13 8.18 Favored Pre-proline 0 CA--C 1.538 0.511 0 CA-C-O 118.834 -0.603 . . . . 0.0 110.493 175.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.45 150.92 36.96 Favored 'Trans proline' 0 N--CA 1.499 1.816 0 C-N-CA 121.552 1.501 . . . . 0.0 112.276 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.465 HD11 HG13 ' A' ' 65' ' ' ILE . 66.1 mt -90.81 123.39 42.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.143 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.393 178.231 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 80.6 p -98.79 163.27 12.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.993 176.041 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -97.82 15.88 61.13 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 120.861 -0.685 . . . . 0.0 113.265 -178.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 40.7 p -111.0 2.1 17.82 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 117.746 0.773 . . . . 0.0 112.956 176.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.3 mt -69.49 141.07 54.01 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 118.077 0.399 . . . . 0.0 111.192 -177.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -113.99 135.8 53.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.739 175.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 67.2 mt -119.38 158.34 26.35 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.986 0.422 . . . . 0.0 111.121 -175.014 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -149.68 141.53 23.73 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 176.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.0 t -105.69 109.17 21.04 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.196 -178.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -106.77 103.66 47.98 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 118.306 -0.854 . . . . 0.0 108.757 170.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.73 143.75 62.95 Favored 'Trans proline' 0 N--CA 1.499 1.81 0 CA-C-N 120.6 1.25 . . . . 0.0 111.955 -171.318 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -90.72 14.46 50.44 Favored 'Cis proline' 0 N--CA 1.501 1.916 0 CA-C-N 121.016 1.398 . . . . 0.0 113.518 -3.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -94.55 161.87 14.03 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 122.36 0.264 . . . . 0.0 110.411 -178.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 46.9 tp -114.93 132.89 56.4 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 172.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.479 HD11 ' CG2' ' A' ' 102' ' ' ILE . 8.6 tp -122.73 139.42 53.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.282 -173.675 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 48.7 p90 -142.93 154.62 44.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.826 0.346 . . . . 0.0 110.488 175.313 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.2 mtm180 -101.78 145.76 28.71 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.7 -178.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -127.68 164.77 21.35 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.659 0.743 . . . . 0.0 111.534 -176.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -47.2 145.62 2.2 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.171 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 12.4 tpt180 65.28 30.91 10.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.322 -0.854 . . . . 0.0 112.019 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.0 t 64.93 35.27 8.41 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.896 0.379 . . . . 0.0 111.527 166.487 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 50.6 mtm180 -98.25 150.63 21.32 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 179.09 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.597 HD13 ' CH2' ' B' 1345 ' ' TRP . 74.2 mt -114.66 127.53 72.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 -178.247 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -140.14 150.39 44.19 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.612 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.7 169.32 26.08 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 120.965 -0.636 . . . . 0.0 111.634 -175.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -125.22 137.3 54.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.389 -0.405 . . . . 0.0 110.4 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 42.7 t90 -107.18 127.53 53.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.6 176.188 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -114.54 146.15 41.09 Favored 'General case' 0 C--N 1.329 -0.294 0 O-C-N 123.223 0.327 . . . . 0.0 110.509 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -51.57 -36.35 44.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.627 177.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -134.08 134.85 42.79 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.416 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.7 t -61.2 -41.81 97.48 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.988 -177.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -59.88 -43.02 94.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.359 0.599 . . . . 0.0 110.176 179.007 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -56.98 -44.54 82.76 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.937 178.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 43.3 t -59.98 -38.71 83.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.698 177.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -59.1 -46.05 89.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.876 0.369 . . . . 0.0 110.502 -177.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 60.6 ttm-85 -59.79 -48.71 80.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.053 0.454 . . . . 0.0 110.579 -178.043 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.655 HG23 HD11 ' A' ' 54' ' ' ILE . 30.1 mm -58.33 -44.56 88.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.052 -179.002 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 53.3 p -59.4 -44.2 92.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.649 -177.297 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.78 -44.59 94.14 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 -178.7 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.516 HD13 ' HB2' ' A' ' 26' ' ' ASP . 10.4 mt -58.73 -48.34 81.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.114 0.483 . . . . 0.0 110.553 -178.507 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 50.6 t -58.9 -43.41 88.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.078 -178.487 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -57.4 -42.43 82.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.636 -178.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.33 -45.3 96.73 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.954 -0.858 . . . . 0.0 110.954 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.6 mt -57.82 -42.69 84.79 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.93 0.395 . . . . 0.0 110.524 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 86.9 mt . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.636 179.869 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 16.8 mt . . . . . 0 C--O 1.232 0.168 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -79.03 139.86 15.47 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 C-N-CA 121.227 1.285 . . . . 0.0 110.841 173.24 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -95.66 125.72 48.13 Favored Pre-proline 0 CA--C 1.534 0.354 0 CA-C-O 118.803 -0.618 . . . . 0.0 109.667 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -77.95 154.03 29.43 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 121.446 1.431 . . . . 0.0 111.643 173.157 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -58.47 154.2 43.27 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 121.313 1.342 . . . . 0.0 111.404 177.305 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B 1343 ' ' LEU . . . . . 0.532 ' H ' HD12 ' B' 1343 ' ' LEU . 6.2 mp -50.66 -30.5 13.73 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -176.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -55.88 -38.04 69.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.82 0.343 . . . . 0.0 111.188 -177.21 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B 1345 ' ' TRP . . . . . 0.597 ' CH2' HD13 ' A' ' 102' ' ' ILE . 7.6 t90 -61.92 -48.06 82.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.151 -177.353 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -60.4 -47.06 87.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.113 0.483 . . . . 0.0 110.519 -177.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -59.93 -45.38 92.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.794 -177.474 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -57.81 -45.15 86.53 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.539 -177.143 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.21 -48.26 82.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.577 -178.208 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.951 -177.223 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 24.8 m . . . . . 0 CA--C 1.526 0.038 0 CA-C-O 120.919 0.39 . . . . 0.0 110.759 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.7 mm -60.66 -46.44 95.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.287 -178.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.5 m -59.12 -43.93 91.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.519 -177.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -59.64 -45.89 90.64 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.607 -178.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 66.0 mtt -58.26 -43.68 88.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.027 0.442 . . . . 0.0 110.347 -178.218 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -60.34 -48.56 81.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.35 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.642 ' HA ' HD12 ' A' ' 14' ' ' ILE . 9.4 tp -60.79 -33.6 73.23 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.051 -178.546 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.59 -49.57 74.74 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.647 0.261 . . . . 0.0 110.673 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.99 -41.97 88.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.015 0.436 . . . . 0.0 110.501 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.664 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 92.9 mt -54.22 -53.01 32.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.535 178.344 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -53.47 -21.75 6.77 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.498 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -58.26 -34.85 70.94 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.584 0.23 . . . . 0.0 111.542 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.747 HG21 ' CB ' ' A' ' 75' ' ' SER . 46.6 mm -113.05 -37.77 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 120.679 0.276 . . . . 0.0 110.815 -176.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.5 t0 -116.7 77.4 8.25 Favored Pre-proline 0 CA--C 1.536 0.416 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.469 -177.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -54.85 -20.41 22.39 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 121.505 1.47 . . . . 0.0 113.416 -177.18 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 44.9 p90 -92.8 15.9 13.63 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -174.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -89.68 124.69 34.82 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 173.505 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.9 mmtp -97.54 -40.52 8.6 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.827 -175.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -153.09 157.52 40.53 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.574 -0.45 . . . . 0.0 111.503 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 46.7 mt -95.36 138.45 21.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.068 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.5 t -91.4 -46.42 14.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.801 176.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.516 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.0 t0 -154.72 156.56 36.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.006 178.768 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.7 p -143.11 132.65 23.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.016 0.436 . . . . 0.0 110.986 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.7 t -108.79 128.08 54.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.869 177.341 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.3 m -54.62 -39.06 67.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.226 -172.031 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -151.53 126.61 9.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.223 0.535 . . . . 0.0 111.742 -178.323 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.43 HG21 ' HB3' ' A' ' 52' ' ' PHE . 97.5 t -145.19 140.38 22.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.472 -177.718 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.52 149.85 50.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.068 -178.663 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.472 ' HD2' HG21 ' A' ' 46' ' ' THR . 21.7 t80 -101.45 130.14 47.63 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.289 0.566 . . . . 0.0 111.649 -176.178 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.432 ' CD2' HD11 ' B' 1338 ' ' LEU . 44.4 m-85 -124.91 142.46 51.45 Favored 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.687 178.612 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 72.1 m -122.07 147.47 46.07 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 177.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -104.79 131.94 51.64 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.018 0.437 . . . . 0.0 110.268 175.221 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -104.44 116.45 32.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.885 178.01 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 86.4 p -68.47 -31.62 71.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.966 -177.183 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -62.79 -38.34 90.29 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.986 -177.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -93.89 -21.48 19.21 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.9 t30 69.08 42.48 1.25 Allowed 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.246 0.546 . . . . 0.0 109.948 -178.019 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -153.12 166.38 32.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.124 -177.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -90.78 142.01 28.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.236 177.049 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -125.06 127.53 47.08 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 176.707 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -72.39 139.79 48.02 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 177.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.472 HG21 ' HD2' ' A' ' 33' ' ' PHE . 68.6 p -92.19 178.62 5.8 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.035 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -89.01 16.12 7.54 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.0 t -112.29 106.4 20.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-O 120.946 0.403 . . . . 0.0 110.557 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -129.75 111.25 12.46 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 173.173 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.67 176.61 38.97 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 120.112 -1.042 . . . . 0.0 112.157 -168.386 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.454 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.33 137.0 37.83 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 175.181 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.43 ' HB3' HG21 ' A' ' 31' ' ' VAL . 5.4 t80 -100.06 127.69 46.25 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.219 -176.511 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.454 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 7.1 m-85 -130.78 142.9 50.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.653 0.263 . . . . 0.0 110.319 177.22 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.688 HD11 HG23 ' A' ' 116' ' ' ILE . 67.4 mt -101.5 127.77 54.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 172.394 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.664 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.2 m-30 -108.48 137.32 46.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.939 0.4 . . . . 0.0 111.262 -175.369 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -117.58 143.34 46.21 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.143 176.457 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 51.4 ttt85 -139.85 147.53 40.81 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.8 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -86.91 28.14 0.93 Allowed 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.6 157.74 32.54 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.14 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -63.88 135.27 96.22 Favored Pre-proline 0 CA--C 1.539 0.553 0 CA-C-O 118.571 -0.728 . . . . 0.0 110.208 -176.29 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -66.71 140.86 51.98 Favored 'Cis proline' 0 N--CA 1.5 1.869 0 CA-C-N 121.66 1.629 . . . . 0.0 111.275 -3.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -68.14 -42.9 79.45 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.163 -176.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.431 ' CD2' HD22 ' A' ' 123' ' ' LEU . 74.6 m80 -143.03 140.58 31.04 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.622 0.725 . . . . 0.0 111.057 -176.389 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.8 t -150.08 152.31 34.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.056 -177.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 46.3 mt -111.48 137.71 42.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -178.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -131.83 142.03 49.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.042 -176.284 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.0 mt -123.44 133.75 68.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.195 0.521 . . . . 0.0 109.872 172.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -101.45 99.93 10.32 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.556 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -72.62 109.0 5.95 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 123.655 0.597 . . . . 0.0 111.037 -175.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -74.4 -40.39 62.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.2 -171.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 54.7 mt -71.19 -45.0 64.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.613 -175.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 53.2 m-20 -95.1 -3.13 48.64 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -175.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.3 p 51.17 42.2 28.51 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.439 0.638 . . . . 0.0 111.092 178.249 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 42.9 m -127.96 149.07 50.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.153 -0.93 . . . . 0.0 109.729 179.164 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.747 ' CB ' HG21 ' A' ' 17' ' ' ILE . 49.0 p -102.28 144.99 30.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.923 0.392 . . . . 0.0 111.161 -177.419 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -138.38 122.16 17.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.301 177.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 p -125.43 148.38 29.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.53 -0.304 . . . . 0.0 111.061 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -146.44 136.46 11.96 Favored Pre-proline 0 CA--C 1.537 0.48 0 CA-C-O 118.992 -0.528 . . . . 0.0 110.507 175.449 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.4 150.92 37.14 Favored 'Trans proline' 0 N--CA 1.498 1.771 0 C-N-CA 121.615 1.544 . . . . 0.0 112.484 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 71.3 mt -90.51 137.26 21.97 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-O 120.916 0.389 . . . . 0.0 110.317 177.663 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.9 p -132.18 155.39 48.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.708 177.075 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.555 ' HA2' HD22 ' A' ' 124' ' ' LEU . . . -96.45 32.0 6.92 Favored Glycine 0 CA--C 1.527 0.789 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.331 -178.706 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 63.4 p -100.85 -26.01 13.91 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 173.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.9 mt -69.01 147.35 51.72 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 120.889 0.375 . . . . 0.0 111.317 -176.138 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -116.2 135.84 53.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.638 175.442 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.3 mt -109.18 159.64 16.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.208 -174.501 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -148.9 141.36 24.26 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 178.499 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.8 t -98.82 109.21 22.0 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.725 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -106.85 103.61 48.0 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 172.365 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -71.32 139.65 35.39 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 CA-C-N 120.613 1.255 . . . . 0.0 112.012 -171.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -89.36 9.48 64.28 Favored 'Cis proline' 0 N--CA 1.5 1.897 0 CA-C-N 121.267 1.488 . . . . 0.0 113.737 -3.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -84.99 170.72 12.74 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.72 0.295 . . . . 0.0 110.858 -177.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 61.8 tp -118.75 132.75 56.15 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 170.619 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.8 tp -124.16 140.06 53.33 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.538 0.208 . . . . 0.0 110.583 -173.663 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 20.5 p90 -145.72 149.89 35.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.851 0.358 . . . . 0.0 110.562 175.521 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 54.5 mtm180 -106.71 148.17 28.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 -177.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -129.56 165.02 22.55 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.837 0.827 . . . . 0.0 111.433 -176.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -47.92 148.15 1.77 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.219 -177.244 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 54.7 ttt180 65.33 30.8 10.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.019 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 31.8 m 65.19 35.24 7.93 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.795 0.331 . . . . 0.0 111.575 165.376 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -99.74 145.95 27.09 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.45 HG21 ' CH2' ' B' 1345 ' ' TRP . 85.2 mt -113.7 130.36 67.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.114 0.483 . . . . 0.0 109.81 -178.517 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -137.91 147.71 44.65 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.433 177.226 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.91 168.16 25.73 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 111.373 -0.691 . . . . 0.0 111.373 -176.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -125.2 140.41 52.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.803 0.335 . . . . 0.0 110.803 -179.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 21.9 t90 -106.89 123.82 48.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.584 175.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -113.33 141.55 46.89 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.824 0.345 . . . . 0.0 110.519 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -51.31 -35.82 39.64 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.672 178.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 -135.57 135.98 40.74 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.33 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 82.7 p -63.39 -40.23 96.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.144 -177.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -60.65 -43.3 97.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.356 0.598 . . . . 0.0 110.096 178.461 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -56.73 -45.8 81.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.563 0.697 . . . . 0.0 109.928 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 47.7 t -60.09 -38.13 82.01 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.811 178.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -59.48 -46.6 88.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.863 0.363 . . . . 0.0 110.514 -177.458 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 72.2 mtm180 -60.07 -48.16 82.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.008 0.433 . . . . 0.0 110.646 -177.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.688 HG23 HD11 ' A' ' 54' ' ' ILE . 28.9 mm -58.42 -44.94 89.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.072 -178.803 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.2 p -59.31 -44.3 92.57 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.679 -177.497 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.48 -44.42 93.71 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -178.762 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.516 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.3 mt -58.59 -48.41 81.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.185 0.517 . . . . 0.0 110.471 -178.601 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.508 HG12 HD11 ' A' ' 124' ' ' LEU . 54.3 t -58.63 -43.52 87.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.185 -178.389 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.8 m120 -58.2 -42.66 86.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.745 -178.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.97 -42.94 99.77 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.409 -0.676 . . . . 0.0 111.409 -178.762 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.431 HD22 ' CD2' ' A' ' 63' ' ' HIS . 50.1 mt -64.1 -43.27 95.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.759 0.314 . . . . 0.0 111.303 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.555 HD22 ' HA2' ' A' ' 82' ' ' GLY . 24.0 mt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.385 -176.349 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B 1338 ' ' LEU . . . . . 0.432 HD11 ' CD2' ' A' ' 34' ' ' TYR . 11.6 mt . . . . . 0 C--O 1.233 0.201 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.1 139.61 15.18 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 121.083 1.189 . . . . 0.0 111.084 174.098 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -97.14 125.9 44.14 Favored Pre-proline 0 CA--C 1.535 0.396 0 CA-C-O 118.442 -0.789 . . . . 0.0 110.007 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -78.17 168.97 21.02 Favored 'Trans proline' 0 N--CA 1.496 1.643 0 C-N-CA 121.315 1.343 . . . . 0.0 111.734 176.143 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.91 152.55 57.12 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 C-N-CA 121.268 1.312 . . . . 0.0 111.344 177.17 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B 1343 ' ' LEU . . . . . 0.534 ' H ' HD12 ' B' 1343 ' ' LEU . 6.1 mp -49.97 -25.23 3.12 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -176.567 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 84.9 m-85 -55.34 -37.65 67.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.742 0.306 . . . . 0.0 111.167 -176.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B 1345 ' ' TRP . . . . . 0.45 ' CH2' HG21 ' A' ' 102' ' ' ILE . 58.2 t90 -61.78 -48.1 82.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.406 -176.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -62.01 -49.55 75.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.981 0.42 . . . . 0.0 110.52 -176.477 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -60.9 -46.05 92.18 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.083 -175.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 42.4 tp10 -59.29 -46.85 87.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.72 -175.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -61.58 -50.75 71.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.891 -176.586 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.5 tt0 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.373 -175.062 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.0 p . . . . . 0 C--O 1.23 0.049 0 CA-C-O 120.975 0.417 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.2 mm -59.75 -44.14 93.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.108 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 32.7 m -59.44 -45.18 92.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.534 -177.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -59.05 -45.96 89.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.369 -178.652 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.5 mtt -58.14 -43.92 87.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.188 0.518 . . . . 0.0 110.387 -177.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -59.95 -49.46 77.61 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.189 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.74 ' HA ' HD12 ' A' ' 14' ' ' ILE . 10.8 tp -58.79 -33.69 70.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.988 -178.678 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.05 -50.94 68.65 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.659 0.266 . . . . 0.0 110.891 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.85 -41.55 82.61 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.967 0.413 . . . . 0.0 110.5 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.74 HD12 ' HA ' ' A' ' 11' ' ' LEU . 88.8 mt -54.31 -52.93 34.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.627 178.439 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -51.43 -24.17 4.67 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt -58.56 -34.11 70.68 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 -177.034 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.697 HG21 ' CB ' ' A' ' 75' ' ' SER . 43.7 mm -110.22 -42.05 4.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.79 0.329 . . . . 0.0 110.239 -177.063 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -116.25 79.23 8.6 Favored Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.137 -178.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -53.86 -19.96 16.45 Favored 'Trans proline' 0 N--CA 1.497 1.717 0 C-N-CA 121.54 1.493 . . . . 0.0 113.498 -176.401 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.3 p90 -95.96 15.23 21.08 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -174.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -91.65 126.59 36.79 Favored 'General case' 0 C--N 1.333 -0.121 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 173.208 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.614 ' O ' HD21 ' A' ' 11' ' ' LEU . 27.6 ttmt -109.34 -38.0 5.6 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 120.835 -0.346 . . . . 0.0 111.37 -172.807 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -132.81 145.54 51.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.962 0.41 . . . . 0.0 111.157 -175.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.427 HD11 HD12 ' A' ' 14' ' ' ILE . 19.2 mt -100.45 133.44 43.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 171.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.1 t -90.57 -47.06 14.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.987 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.503 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.0 t0 -153.82 156.08 37.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.994 179.062 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.7 p -142.57 132.05 23.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.102 0.477 . . . . 0.0 110.917 179.44 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.0 t -108.52 127.37 53.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.731 177.228 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 86.9 p -54.78 -38.24 67.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.28 -172.258 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -151.19 126.36 9.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.215 0.531 . . . . 0.0 111.764 -178.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.422 HG21 ' HB3' ' A' ' 52' ' ' PHE . 97.3 t -145.28 140.12 22.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.32 -177.775 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -130.22 149.85 51.73 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.17 -177.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.514 ' CD2' HG21 ' A' ' 46' ' ' THR . 11.0 t80 -96.85 133.55 41.32 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.313 0.578 . . . . 0.0 111.638 -176.743 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -125.77 140.91 52.29 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.404 177.087 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 86.2 m -123.0 144.06 49.51 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 177.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -105.31 130.24 53.48 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.901 0.381 . . . . 0.0 110.155 175.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -101.56 115.52 30.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.785 176.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.5 m -67.48 -33.18 74.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.895 -177.626 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.3 m -61.54 -38.08 86.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.631 0.253 . . . . 0.0 111.021 -177.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -94.92 -21.37 18.69 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.526 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 22.5 t30 68.99 45.44 0.92 Allowed 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.519 0.676 . . . . 0.0 109.558 -177.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 74.5 tt0 -155.96 151.63 27.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.203 -177.074 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 88.8 m95 -84.32 142.46 30.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.123 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -125.02 131.49 53.38 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.01 -0.366 . . . . 0.0 110.01 176.669 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 55.8 pttt -74.87 136.79 41.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.277 178.353 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.514 HG21 ' CD2' ' A' ' 33' ' ' PHE . 72.4 p -92.31 168.46 11.3 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.775 -0.37 . . . . 0.0 110.285 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -74.22 -18.49 60.74 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.5 t -75.51 106.39 5.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-O 121.042 0.448 . . . . 0.0 110.457 -178.004 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -133.29 110.95 10.43 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 174.476 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.61 176.54 38.92 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 120.277 -0.963 . . . . 0.0 112.252 -168.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.462 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.39 135.48 37.45 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 174.662 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.422 ' HB3' HG21 ' A' ' 31' ' ' VAL . 5.3 t80 -99.12 127.48 45.08 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.134 -176.137 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.462 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 7.1 m-85 -130.72 142.4 50.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.297 177.271 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.674 HD11 HG23 ' A' ' 116' ' ' ILE . 66.5 mt -101.54 127.51 54.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 172.43 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.667 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.8 m-30 -108.47 136.22 48.46 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.994 0.426 . . . . 0.0 111.394 -175.27 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 79.0 t60 -112.05 143.34 43.22 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.247 174.624 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -142.01 146.58 35.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.041 178.213 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -86.89 28.04 0.94 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.267 -0.424 . . . . 0.0 112.081 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.6 169.53 24.21 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -64.02 125.29 87.67 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-O 118.441 -0.79 . . . . 0.0 110.018 -178.566 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -78.39 141.0 63.19 Favored 'Cis proline' 0 N--CA 1.497 1.677 0 CA-C-N 121.92 1.721 . . . . 0.0 111.831 -1.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -64.9 -41.5 95.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.993 -177.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -142.71 136.97 29.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.365 0.602 . . . . 0.0 110.935 -177.034 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.1 t -150.55 152.35 34.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.38 -178.037 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.419 HG13 HD11 ' A' ' 80' ' ' ILE . 43.0 mt -111.15 138.44 39.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 -178.876 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -131.88 142.0 49.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.955 -176.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 62.8 mt -123.5 132.76 70.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.255 0.55 . . . . 0.0 109.784 172.497 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -99.15 99.52 10.52 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.234 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 56.8 t-20 -76.56 107.82 9.1 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 121.748 0.785 . . . . 0.0 110.86 -174.566 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 60.7 ttm-85 -73.41 -35.98 65.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.516 -170.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.6 mt -71.47 -45.35 62.78 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.999 -173.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 42.1 p-10 -95.2 -3.35 47.9 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -177.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.7 m 58.32 44.25 18.8 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.497 0.665 . . . . 0.0 109.97 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 29.3 m -134.35 149.06 50.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.224 -177.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.697 ' CB ' HG21 ' A' ' 17' ' ' ILE . 10.8 p -101.85 144.99 29.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.283 -177.596 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -137.31 122.24 18.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.444 177.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 13.0 p -125.42 149.22 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-O 120.933 0.397 . . . . 0.0 111.177 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -147.83 131.35 8.26 Favored Pre-proline 0 CA--C 1.538 0.513 0 CA-C-O 118.747 -0.644 . . . . 0.0 110.241 176.329 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -75.35 150.84 37.25 Favored 'Trans proline' 0 N--CA 1.5 1.872 0 C-N-CA 121.475 1.45 . . . . 0.0 112.432 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.419 HD11 HG13 ' A' ' 65' ' ' ILE . 62.5 mt -90.69 123.01 42.67 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-O 120.846 0.355 . . . . 0.0 110.488 179.276 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 73.0 p -99.66 154.61 18.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.869 174.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -92.69 24.14 25.1 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.868 -179.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 38.8 p -111.03 -9.91 14.38 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 175.19 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.9 mt -67.74 140.39 56.72 Favored 'General case' 0 C--O 1.232 0.142 0 O-C-N 122.112 -0.367 . . . . 0.0 111.275 -176.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.9 tt0 -113.48 135.81 53.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.853 176.187 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 61.3 mt -113.61 161.31 17.59 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.75 -176.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -149.99 143.71 25.37 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.283 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.3 t -99.69 109.25 21.73 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.515 179.094 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -106.75 103.75 48.29 Favored Pre-proline 0 C--N 1.329 -0.321 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 173.278 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -67.92 140.1 49.36 Favored 'Trans proline' 0 N--CA 1.496 1.647 0 CA-C-N 120.403 1.179 . . . . 0.0 111.784 -172.162 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -89.76 9.24 64.61 Favored 'Cis proline' 0 N--CA 1.5 1.899 0 CA-C-N 121.239 1.478 . . . . 0.0 113.699 -5.479 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -89.58 172.79 8.71 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.607 0.241 . . . . 0.0 110.815 -176.05 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.8 tp -115.95 136.38 53.1 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 172.199 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 11.6 tp -129.5 140.64 51.2 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.617 0.246 . . . . 0.0 110.654 -174.336 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -146.39 157.32 43.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.808 0.337 . . . . 0.0 110.418 175.22 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.4 mtm105 -101.88 144.79 30.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.629 -177.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -127.49 163.02 25.03 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.951 0.881 . . . . 0.0 111.854 -176.23 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -47.77 149.98 1.16 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.36 -0.837 . . . . 0.0 112.177 -177.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 93.0 mtt180 62.21 30.8 17.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.158 -0.928 . . . . 0.0 112.102 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 69.6 m 65.74 35.23 6.97 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.866 0.365 . . . . 0.0 111.487 165.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 68.1 mtp180 -101.23 151.37 21.94 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 78.5 mt -111.37 126.75 68.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 -178.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 32.9 mtp180 -130.82 145.35 51.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.658 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -140.84 167.98 25.44 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -127.96 141.71 51.45 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.952 0.406 . . . . 0.0 110.882 -178.343 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 70.8 t90 -106.72 124.67 49.95 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.518 175.221 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -114.01 140.43 48.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.677 0.275 . . . . 0.0 110.512 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 68.9 t80 -51.7 -36.72 47.84 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.665 178.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 37.3 t-20 -134.46 135.66 42.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.438 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.3 m -61.22 -42.05 97.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.07 -177.479 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -59.85 -43.4 94.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.399 0.619 . . . . 0.0 110.136 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -56.78 -44.87 82.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.49 0.662 . . . . 0.0 110.079 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 45.9 t -59.7 -39.83 85.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.673 178.104 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -58.79 -44.86 90.83 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.848 0.356 . . . . 0.0 110.669 -177.523 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -60.79 -49.79 76.07 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.73 -177.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.674 HG23 HD11 ' A' ' 54' ' ' ILE . 32.9 mm -58.47 -44.57 89.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.051 0.453 . . . . 0.0 109.982 -178.493 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 60.1 p -59.79 -44.16 94.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.677 -177.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.66 -43.69 94.28 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.67 -0.972 . . . . 0.0 110.67 -178.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.503 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.1 mt -59.18 -49.01 79.49 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.118 0.485 . . . . 0.0 110.617 -178.308 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 53.8 t -58.9 -43.51 88.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.083 -178.398 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -58.03 -42.52 85.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.865 0.364 . . . . 0.0 110.674 -178.64 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.97 -41.47 99.66 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 -179.058 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 36.3 mt -62.5 -43.16 99.5 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.878 0.371 . . . . 0.0 111.119 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 79.9 mt . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.618 -176.739 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 13.2 mt . . . . . 0 CA--C 1.531 0.219 0 CA-C-O 119.04 -0.505 . . . . 0.0 109.762 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -79.19 139.93 15.25 Favored 'Trans proline' 0 N--CA 1.493 1.475 0 C-N-CA 121.178 1.252 . . . . 0.0 111.33 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 25.4 mmtp -97.16 125.69 44.87 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-O 118.85 -0.595 . . . . 0.0 109.798 178.558 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 9.4 Cg_exo -74.18 158.32 45.39 Favored 'Trans proline' 0 N--CA 1.497 1.732 0 C-N-CA 121.464 1.442 . . . . 0.0 112.11 172.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -53.63 157.11 10.3 Favored 'Trans proline' 0 N--CA 1.496 1.639 0 C-N-CA 121.381 1.387 . . . . 0.0 111.932 178.328 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 80.7 mt -49.98 -28.17 6.48 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -177.214 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -54.74 -37.58 66.09 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.922 0.391 . . . . 0.0 111.126 -177.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 41.9 t90 -60.85 -47.96 84.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.244 -178.23 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -59.93 -46.65 88.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.992 0.425 . . . . 0.0 110.307 -177.414 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -59.23 -45.97 89.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.661 -177.765 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -57.74 -44.71 86.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.573 -177.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.19 -47.56 85.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.673 -177.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 . . . . . 0 C--N 1.327 -0.406 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.828 -177.103 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.4 m . . . . . 0 CA--C 1.526 0.056 0 CA-C-O 120.924 0.393 . . . . 0.0 110.498 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.3 mm -59.64 -44.76 94.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.088 -179.378 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.4 m -59.25 -45.2 91.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.986 0.422 . . . . 0.0 110.481 -177.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.0 mmt180 -58.99 -45.72 89.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.468 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.8 mtt -58.26 -43.79 88.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.121 0.486 . . . . 0.0 110.44 -178.116 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -59.28 -48.37 81.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.21 -178.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.651 ' HA ' HD12 ' A' ' 14' ' ' ILE . 9.4 tp -60.36 -33.39 72.36 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.146 -179.274 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.91 -49.77 74.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.677 0.275 . . . . 0.0 110.662 179.273 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.06 -41.95 89.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.974 0.416 . . . . 0.0 110.434 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.658 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 93.5 mt -54.28 -52.85 34.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.627 178.349 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -51.85 -27.29 12.13 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -177.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -58.94 -32.81 69.93 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -177.248 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.1 mm -106.17 -44.95 8.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.026 0.441 . . . . 0.0 110.064 -177.462 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -117.12 79.16 10.56 Favored Pre-proline 0 CA--C 1.535 0.4 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.276 -177.536 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -54.32 -20.22 19.29 Favored 'Trans proline' 0 N--CA 1.497 1.721 0 C-N-CA 121.473 1.449 . . . . 0.0 113.561 -175.318 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 14.5 p90 -93.52 15.13 16.74 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -174.329 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -81.28 128.12 33.46 Favored 'General case' 0 C--N 1.334 -0.1 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 173.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -97.51 -40.36 8.7 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.704 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -159.03 159.88 35.22 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.679 -0.409 . . . . 0.0 111.408 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 39.8 mt -96.22 138.39 21.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.052 178.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.9 t -90.87 -47.21 14.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.856 176.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.497 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.0 t0 -154.0 158.13 40.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.933 178.618 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 18.6 p -143.89 133.24 23.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.971 0.415 . . . . 0.0 111.153 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.3 t -110.12 127.8 55.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.74 177.204 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.4 m -54.86 -39.75 68.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.206 -171.676 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -149.81 125.91 10.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.262 0.553 . . . . 0.0 111.818 -178.138 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.442 HG21 ' HB3' ' A' ' 52' ' ' PHE . 97.2 t -145.19 142.25 22.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.447 -177.694 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.59 149.84 51.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.164 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -99.01 131.43 45.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.233 0.539 . . . . 0.0 111.519 -177.043 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -125.82 144.23 50.73 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.807 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 80.4 m -121.32 148.56 44.17 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -109.8 130.84 55.48 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.874 0.368 . . . . 0.0 110.452 176.135 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 36.9 t-20 -101.07 113.0 25.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.834 176.214 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.1 m -67.5 -32.73 73.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.976 -177.026 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.5 m -62.31 -38.52 89.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.666 0.269 . . . . 0.0 111.043 -177.187 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -94.72 -21.41 18.77 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -178.196 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 27.2 t30 68.74 45.76 0.99 Allowed 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.485 0.659 . . . . 0.0 109.356 -177.187 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -151.42 151.23 31.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.07 -176.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.42 ' CB ' HD12 ' B' 1338 ' ' LEU . 81.0 m95 -87.65 141.28 28.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.341 177.496 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -125.02 130.47 52.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.17 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -76.47 139.93 41.03 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.9 p -92.31 177.42 6.15 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.13 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.7 p30 -86.98 12.96 10.02 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.9 t -106.62 106.44 20.62 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-O 120.988 0.423 . . . . 0.0 110.377 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -130.1 112.55 13.53 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 174.422 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.56 38.96 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 120.157 -1.02 . . . . 0.0 112.148 -168.709 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.456 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -79.77 135.42 36.49 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 175.383 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.442 ' HB3' HG21 ' A' ' 31' ' ' VAL . 6.3 t80 -98.27 129.22 44.99 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.113 -176.63 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.456 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.6 m-85 -132.57 143.4 49.68 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.103 177.4 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.718 HD11 HG23 ' A' ' 116' ' ' ILE . 69.9 mt -101.57 128.12 54.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 172.609 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.658 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 13.4 m-30 -108.42 135.91 48.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.991 0.424 . . . . 0.0 111.247 -175.011 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 83.4 t60 -116.37 143.35 45.66 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.917 176.196 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -141.98 148.18 38.16 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.121 179.163 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -86.82 28.06 0.93 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 116.264 -0.426 . . . . 0.0 112.059 179.174 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.72 162.57 38.57 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.239 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 24.8 mp0 -64.06 130.7 94.67 Favored Pre-proline 0 CA--C 1.539 0.535 0 CA-C-O 118.517 -0.754 . . . . 0.0 110.031 -177.236 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.46 140.93 69.28 Favored 'Cis proline' 0 N--CA 1.498 1.739 0 CA-C-N 121.795 1.677 . . . . 0.0 111.63 -1.708 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -65.6 -42.69 91.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.04 -177.428 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.409 ' CD2' HD22 ' A' ' 123' ' ' LEU . 65.4 m80 -141.8 139.04 32.64 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.426 0.631 . . . . 0.0 110.917 -176.526 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.2 t -150.79 151.96 33.11 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.294 -178.334 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.7 mt -108.33 139.14 31.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -179.47 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.402 ' CD2' HG22 ' A' ' 77' ' ' VAL . 32.8 t80 -131.8 141.99 49.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.741 -176.591 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.0 mt -127.15 129.96 71.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-O 121.204 0.526 . . . . 0.0 110.048 173.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -96.17 99.52 11.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.539 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.2 t-20 -71.12 105.23 3.3 Favored 'General case' 0 C--N 1.332 -0.182 0 O-C-N 123.66 0.6 . . . . 0.0 110.8 -176.329 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 77.0 mtp85 -73.58 -38.62 65.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.489 -170.486 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 62.8 mt -75.15 -45.2 42.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.658 -174.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -95.13 -3.26 48.28 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 -175.607 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.427 HG22 ' O ' ' A' ' 73' ' ' THR . 11.9 m 54.89 43.11 30.48 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 121.441 0.638 . . . . 0.0 110.652 177.546 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.3 m -125.98 148.63 49.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.579 -177.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 76.2 p -94.74 130.27 41.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.127 -179.615 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -123.51 122.27 37.78 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 174.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.402 HG22 ' CD2' ' A' ' 66' ' ' PHE . 39.5 t -125.53 147.05 30.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.796 -176.462 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -146.6 126.45 6.77 Favored Pre-proline 0 CA--C 1.539 0.554 0 CA-C-O 118.683 -0.675 . . . . 0.0 110.37 174.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -75.37 150.89 37.24 Favored 'Trans proline' 0 N--CA 1.498 1.762 0 C-N-CA 121.471 1.447 . . . . 0.0 112.418 178.621 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 67.3 mt -93.59 138.78 19.55 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 CA-C-O 120.967 0.413 . . . . 0.0 110.263 178.068 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.429 ' OG1' HD23 ' A' ' 84' ' ' LEU . 60.2 p -132.17 157.16 44.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.688 177.019 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -90.91 31.81 5.43 Favored Glycine 0 CA--C 1.528 0.854 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.296 -178.679 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 54.5 p -111.07 -17.99 13.13 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 174.215 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.429 HD23 ' OG1' ' A' ' 81' ' ' THR . 4.5 mm? -67.82 141.52 56.46 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-O 120.926 0.393 . . . . 0.0 110.976 -175.731 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.7 tt0 -111.96 135.91 51.98 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.661 175.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 68.9 mt -115.39 156.92 24.67 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.945 0.402 . . . . 0.0 110.984 -176.415 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -148.85 142.4 25.39 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 177.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.0 t -99.05 109.14 21.91 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.668 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -106.8 103.71 48.3 Favored Pre-proline 0 C--N 1.328 -0.34 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 172.538 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -70.03 140.3 41.34 Favored 'Trans proline' 0 N--CA 1.497 1.699 0 CA-C-N 120.468 1.203 . . . . 0.0 112.013 -171.203 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -89.8 9.92 62.85 Favored 'Cis proline' 0 N--CA 1.501 1.922 0 CA-C-N 121.317 1.506 . . . . 0.0 113.756 -4.009 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -88.22 170.21 11.21 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.694 0.283 . . . . 0.0 110.981 -177.259 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 55.9 tp -116.55 133.77 55.62 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 171.224 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.484 HD11 ' CG2' ' A' ' 102' ' ' ILE . 10.7 tp -125.37 139.09 53.98 Favored 'General case' 0 C--N 1.333 -0.137 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 -174.836 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -143.93 151.96 40.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.998 0.428 . . . . 0.0 110.65 175.256 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 30.3 mtm180 -104.47 144.09 32.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.668 -177.354 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -129.09 166.5 19.15 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.917 0.865 . . . . 0.0 111.811 -176.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -47.7 148.29 1.58 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.279 -176.862 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 63.41 30.85 15.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.126 -0.943 . . . . 0.0 112.256 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 67.3 m 65.67 35.25 7.08 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.848 0.356 . . . . 0.0 111.526 166.134 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 27.7 mmt180 -99.26 145.9 26.78 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.708 HD13 ' CH2' ' B' 1345 ' ' TRP . 82.7 mt -114.93 127.47 72.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 121.088 0.47 . . . . 0.0 109.792 -178.377 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -136.78 150.33 48.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.506 179.146 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.52 169.47 25.13 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 111.41 -0.676 . . . . 0.0 111.41 -175.311 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -125.21 138.56 54.12 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.998 0.428 . . . . 0.0 110.625 -178.424 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -106.45 120.37 41.74 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.893 -1.049 . . . . 0.0 109.583 177.194 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -112.77 139.75 48.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.809 0.337 . . . . 0.0 110.719 -178.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -51.58 -37.51 50.18 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.63 178.444 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.6 t-20 -132.96 135.65 45.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.764 0.316 . . . . 0.0 110.431 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.7 t -61.36 -42.05 98.07 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.051 -177.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 -59.65 -43.23 94.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.362 0.601 . . . . 0.0 110.152 178.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -56.91 -45.01 82.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.432 0.634 . . . . 0.0 109.998 178.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 46.5 t -59.51 -39.75 84.84 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.588 178.18 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -59.51 -45.41 91.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.8 0.334 . . . . 0.0 110.704 -177.149 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 -60.11 -49.35 78.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.054 0.454 . . . . 0.0 110.663 -177.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.718 HG23 HD11 ' A' ' 54' ' ' ILE . 31.7 mm -58.42 -44.86 89.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.974 -178.653 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 55.8 p -59.31 -43.97 92.61 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.708 -177.638 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.61 -44.03 94.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -178.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.497 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.7 mt -58.47 -48.68 79.98 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.234 0.54 . . . . 0.0 110.514 -178.737 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 52.7 t -58.71 -43.13 87.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.156 -178.507 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 26.9 m120 -58.34 -42.35 86.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.849 0.357 . . . . 0.0 110.664 -178.7 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.77 -41.16 99.58 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.409 HD22 ' CD2' ' A' ' 63' ' ' HIS . 50.3 mt -63.97 -45.01 91.02 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.794 0.33 . . . . 0.0 111.18 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 36.1 mt . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.295 -176.246 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B 1338 ' ' LEU . . . . . 0.42 HD12 ' CB ' ' A' ' 43' ' ' TRP . 21.9 mt . . . . . 0 C--O 1.233 0.198 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -78.99 139.66 15.41 Favored 'Trans proline' 0 N--CA 1.491 1.364 0 C-N-CA 120.915 1.076 . . . . 0.0 111.201 175.415 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 5.4 mmmm -97.28 125.93 43.73 Favored Pre-proline 0 CA--C 1.536 0.432 0 CA-C-O 118.456 -0.783 . . . . 0.0 109.966 178.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -78.18 168.47 21.76 Favored 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 121.257 1.305 . . . . 0.0 111.937 175.387 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -65.71 154.57 73.25 Favored 'Trans proline' 0 N--CA 1.495 1.562 0 C-N-CA 121.259 1.306 . . . . 0.0 111.305 175.436 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.3 tp -50.01 -29.62 9.01 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -176.594 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 65.3 t80 -54.96 -36.83 65.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.818 0.342 . . . . 0.0 111.349 -176.804 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B 1345 ' ' TRP . . . . . 0.708 ' CH2' HD13 ' A' ' 102' ' ' ILE . 23.6 t90 -61.53 -48.15 82.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.423 -176.402 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -61.89 -49.15 77.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.121 0.486 . . . . 0.0 110.366 -178.266 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -58.82 -44.96 90.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.871 -176.51 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -59.04 -46.84 87.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.623 -176.358 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.38 -47.19 86.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.052 0.453 . . . . 0.0 110.652 -177.761 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 . . . . . 0 C--N 1.328 -0.366 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.013 -176.264 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.1 t . . . . . 0 CA--C 1.527 0.062 0 CA-C-O 120.904 0.383 . . . . 0.0 110.662 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.6 mm -59.93 -45.31 95.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.199 -178.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.9 m -59.14 -44.62 92.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.467 -178.03 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -59.43 -46.15 89.54 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.593 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 88.4 mtp -58.17 -43.72 87.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.053 0.454 . . . . 0.0 110.423 -178.285 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -59.99 -48.65 80.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.268 -178.366 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.629 ' HA ' HD12 ' A' ' 14' ' ' ILE . 9.8 tp -60.72 -32.89 72.13 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.729 -0.388 . . . . 0.0 111.175 -179.094 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.22 -49.86 74.08 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.726 0.298 . . . . 0.0 110.632 179.003 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.8 -42.13 88.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.057 0.456 . . . . 0.0 110.456 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.715 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 97.7 mt -54.28 -52.88 34.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.627 178.476 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -53.26 -23.7 9.58 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.407 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -57.93 -34.65 70.11 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 120.611 0.244 . . . . 0.0 111.575 -178.049 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 48.0 mm -107.77 -42.83 6.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.973 0.416 . . . . 0.0 110.208 -177.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -117.16 77.43 9.39 Favored Pre-proline 0 CA--C 1.535 0.372 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.808 -179.272 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -55.72 -21.19 31.13 Favored 'Trans proline' 0 N--CA 1.498 1.752 0 C-N-CA 121.524 1.482 . . . . 0.0 113.447 -174.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.7 p90 -87.47 -2.15 58.42 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -174.31 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.33 127.21 31.34 Favored 'General case' 0 N--CA 1.461 0.095 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 177.133 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -97.54 -40.35 8.69 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.653 -175.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -154.79 157.44 37.95 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.3 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 35.4 mt -93.87 136.75 24.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.824 177.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.5 t -87.41 -44.98 16.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.68 177.272 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.504 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -158.35 157.94 33.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.845 178.561 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.2 p -142.87 132.9 24.32 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.999 0.428 . . . . 0.0 111.266 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.6 t -109.98 125.74 53.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.663 176.378 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.1 m -54.84 -38.93 68.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.169 -172.448 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -148.89 126.45 11.67 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.247 0.546 . . . . 0.0 111.76 -178.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.498 HG22 ' CD1' ' A' ' 107' ' ' PHE . 97.3 t -145.2 140.19 22.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.333 -178.0 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.91 149.84 51.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.722 0.296 . . . . 0.0 111.268 -177.244 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.481 ' HD2' HG21 ' A' ' 46' ' ' THR . 25.6 t80 -100.77 130.33 46.78 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.549 -176.742 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -126.23 143.96 50.95 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.73 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 96.2 m -123.51 146.73 47.86 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -108.64 132.0 54.33 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.962 0.41 . . . . 0.0 110.333 176.481 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -105.18 114.22 28.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.82 176.748 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 84.8 p -70.8 -29.69 65.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.0 -0.546 . . . . 0.0 112.338 -175.798 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.3 t -58.9 -39.23 80.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.805 0.336 . . . . 0.0 110.943 -177.317 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -100.58 -17.88 16.86 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.9 t30 69.82 48.05 0.59 Allowed 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.596 0.712 . . . . 0.0 109.46 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -153.57 151.62 29.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.774 -178.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -88.37 142.78 27.45 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.393 178.02 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -124.99 130.39 52.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.86 176.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.5 pttp -75.02 141.26 43.94 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 177.554 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.481 HG21 ' HD2' ' A' ' 33' ' ' PHE . 67.5 p -92.3 175.55 6.8 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.699 -0.401 . . . . 0.0 110.067 -179.019 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -85.31 13.28 6.72 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.7 t -107.95 106.36 20.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-O 121.014 0.435 . . . . 0.0 110.351 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -132.1 112.2 12.12 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 174.344 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.64 176.53 38.95 Favored Glycine 0 CA--C 1.52 0.389 0 C-N-CA 120.184 -1.007 . . . . 0.0 112.222 -168.766 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.494 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.97 135.37 36.91 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 175.198 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.445 ' HB3' HG21 ' A' ' 31' ' ' VAL . 7.0 t80 -98.94 127.75 44.94 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.107 -176.722 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.494 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 9.2 m-85 -131.75 141.97 49.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.331 177.723 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.64 HD11 HG23 ' A' ' 116' ' ' ILE . 63.9 mt -101.59 129.24 53.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 173.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.715 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 10.3 m-30 -108.49 137.38 46.54 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.791 0.329 . . . . 0.0 111.213 -175.67 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 57.6 t60 -121.35 143.3 49.27 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.289 176.191 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 29.1 ttp180 -142.01 153.84 44.56 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.303 177.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -86.85 28.17 0.92 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.152 -179.198 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -155.78 152.87 29.0 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -63.95 133.55 95.62 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-O 118.5 -0.762 . . . . 0.0 110.243 -176.559 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -68.19 140.92 57.98 Favored 'Cis proline' 0 N--CA 1.499 1.794 0 CA-C-N 121.703 1.644 . . . . 0.0 111.45 -0.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -66.74 -41.32 88.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.135 -176.449 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.414 ' HB3' HD12 ' A' ' 80' ' ' ILE . 74.0 m80 -142.44 143.42 32.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.7 0.762 . . . . 0.0 111.249 -175.523 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.6 t -150.31 151.95 33.72 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.847 -179.041 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 48.2 mt -112.35 138.4 41.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 -177.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -131.79 142.09 49.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.03 -177.778 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.8 mt -123.06 131.87 72.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.252 0.549 . . . . 0.0 109.783 172.383 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -97.8 99.58 10.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.426 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -72.03 107.28 4.66 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 123.618 0.573 . . . . 0.0 110.992 -175.417 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -73.4 -41.96 62.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.278 -171.678 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 74.7 mt -70.3 -45.13 66.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.671 -175.236 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 39.9 m-20 -95.09 -3.23 48.48 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -175.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.8 p 51.07 42.31 28.43 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.523 0.678 . . . . 0.0 111.065 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 38.5 m -125.2 149.08 48.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.164 -179.473 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.4 p -98.2 137.73 36.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.999 -178.125 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -132.97 122.19 23.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.118 175.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 p -125.62 150.38 30.89 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.049 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -148.71 132.8 8.68 Favored Pre-proline 0 CA--C 1.538 0.503 0 CA-C-O 118.879 -0.581 . . . . 0.0 110.401 174.769 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -75.46 150.95 36.93 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 121.578 1.518 . . . . 0.0 112.29 179.346 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.414 HD12 ' HB3' ' A' ' 63' ' ' HIS . 69.7 mt -90.51 136.31 24.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.2 177.607 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.6 p -132.14 158.49 41.53 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.839 177.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -95.7 35.46 4.3 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.058 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.3 p -109.0 -23.33 11.74 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 173.603 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.89 147.68 51.34 Favored 'General case' 0 C--O 1.231 0.082 0 CA-C-O 120.887 0.375 . . . . 0.0 111.207 -176.393 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 59.3 tt0 -118.56 135.91 54.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.799 175.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 51.6 mt -114.25 161.05 18.34 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.715 -176.552 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -150.06 142.68 24.53 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 177.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.0 t -98.5 109.15 21.95 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.444 -0.502 . . . . 0.0 110.588 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 -106.9 103.75 48.74 Favored Pre-proline 0 C--N 1.328 -0.344 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 171.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -70.26 143.15 47.59 Favored 'Trans proline' 0 N--CA 1.497 1.734 0 CA-C-N 120.496 1.213 . . . . 0.0 112.003 -171.378 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -91.17 14.73 49.52 Favored 'Cis proline' 0 N--CA 1.499 1.798 0 CA-C-N 120.964 1.38 . . . . 0.0 113.561 -3.75 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -97.0 172.64 7.73 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.458 0.171 . . . . 0.0 110.58 -177.4 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 52.5 tp -114.5 135.07 54.52 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 173.031 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.419 HD21 ' HZ2' ' B' 1345 ' ' TRP . 9.4 tp -127.17 139.56 52.87 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 -174.273 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 19.6 p90 -146.61 160.9 41.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.91 0.386 . . . . 0.0 110.614 175.411 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 30.5 mtm105 -101.9 146.15 28.24 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.471 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -127.26 164.64 21.27 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.78 0.8 . . . . 0.0 111.732 -176.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -48.0 147.51 2.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.203 -176.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 63.23 30.95 15.78 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.152 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 46.5 t 66.62 35.2 5.45 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.896 0.379 . . . . 0.0 111.583 166.342 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -100.74 152.63 20.25 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.255 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 73.9 mt -110.19 129.18 65.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 -179.239 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -138.3 150.25 46.45 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.789 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -144.29 169.34 26.38 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 111.359 -0.696 . . . . 0.0 111.359 -176.596 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -125.34 140.96 52.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.948 0.404 . . . . 0.0 110.809 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 17.2 t90 -108.38 127.74 54.15 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.81 175.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.498 ' CD1' HG22 ' A' ' 31' ' ' VAL . 79.4 m-85 -115.26 142.02 47.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.762 0.315 . . . . 0.0 110.356 178.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -50.93 -38.25 49.05 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.78 178.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -133.39 137.27 45.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.309 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.0 m -59.81 -41.74 91.92 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.957 -177.307 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -58.17 -42.24 85.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.285 0.564 . . . . 0.0 110.18 178.211 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -57.26 -44.78 84.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.508 0.67 . . . . 0.0 109.909 178.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 43.5 t -59.22 -37.01 76.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.797 176.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -63.11 -51.73 65.39 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 121.208 -0.197 . . . . 0.0 111.182 -174.228 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 29.6 ptt180 -64.76 -42.41 95.14 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.35 -0.54 . . . . 0.0 111.339 -175.005 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.64 HG23 HD11 ' A' ' 54' ' ' ILE . 26.5 mm -60.04 -48.13 89.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.175 0 C-N-CA 120.507 -0.477 . . . . 0.0 109.883 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 66.5 p -59.32 -43.2 92.71 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.832 0.349 . . . . 0.0 110.644 -177.195 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.77 -43.73 94.47 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.631 -0.987 . . . . 0.0 110.631 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.504 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.1 mt -57.93 -47.78 81.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.214 0.531 . . . . 0.0 110.497 -178.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 49.3 t -59.01 -44.14 90.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.035 -179.12 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -57.36 -42.74 82.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.689 -178.466 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.12 -46.02 95.37 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.006 -0.838 . . . . 0.0 111.006 -178.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 56.9 mt -57.83 -43.07 85.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.016 0.436 . . . . 0.0 110.507 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 39.3 mt . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.802 -179.838 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 8.3 mt . . . . . 0 CA--C 1.533 0.307 0 CA-C-O 118.169 -0.92 . . . . 0.0 109.412 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -79.14 139.55 15.08 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 CA-C-N 120.615 1.255 . . . . 0.0 111.155 174.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 41.6 mtmt -97.38 126.02 43.21 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-O 118.453 -0.784 . . . . 0.0 110.32 179.346 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -64.55 167.8 14.38 Favored 'Trans proline' 0 N--CA 1.498 1.757 0 CA-C-N 120.564 1.237 . . . . 0.0 111.619 175.412 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -56.55 157.11 19.74 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 121.402 1.401 . . . . 0.0 111.445 178.627 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 12.3 tp -50.01 -29.96 9.68 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -176.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 58.2 t80 -54.95 -37.42 66.43 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.921 0.391 . . . . 0.0 111.161 -177.815 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B 1345 ' ' TRP . . . . . 0.419 ' HZ2' HD21 ' A' ' 94' ' ' LEU . 43.6 t90 -60.2 -48.05 83.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.225 -177.715 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -61.88 -47.94 82.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.026 0.441 . . . . 0.0 110.626 -177.177 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -59.63 -45.09 93.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.86 -177.099 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 42.7 tp10 -59.23 -46.17 89.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.695 -176.476 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.26 -48.34 82.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.039 0.447 . . . . 0.0 110.751 -177.364 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 . . . . . 0 C--N 1.328 -0.359 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.15 -176.597 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.4 m . . . . . 0 CA--C 1.527 0.064 0 CA-C-O 120.908 0.385 . . . . 0.0 110.639 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.7 mm -59.56 -44.82 94.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.128 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.5 m -58.62 -45.07 90.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.061 0.458 . . . . 0.0 110.439 -178.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -59.26 -45.38 91.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.58 -178.728 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 89.2 mtp -58.27 -42.4 86.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.449 -178.125 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -60.1 -49.93 75.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.287 -178.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.736 ' HA ' HD12 ' A' ' 14' ' ' ILE . 12.7 tp -60.53 -31.02 70.12 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.323 -179.303 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.76 -50.92 67.17 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.676 0.274 . . . . 0.0 110.733 178.392 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.36 -40.23 81.7 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.953 0.406 . . . . 0.0 110.674 179.35 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.736 HD12 ' HA ' ' A' ' 11' ' ' LEU . 97.7 mt -54.24 -52.9 33.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.485 177.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -51.55 -22.38 3.2 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.795 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.9 mmtt -58.72 -35.09 72.12 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 122.296 -0.253 . . . . 0.0 111.631 -178.097 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 48.2 mm -108.19 -43.26 6.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.908 0.385 . . . . 0.0 110.116 -177.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -117.36 77.3 9.98 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.129 -176.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -54.84 -22.45 29.86 Favored 'Trans proline' 0 N--CA 1.498 1.747 0 C-N-CA 121.5 1.466 . . . . 0.0 113.33 -176.256 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.0 p90 -88.65 8.74 27.02 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -175.011 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -88.61 123.81 33.44 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 174.399 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.475 ' O ' HD21 ' A' ' 11' ' ' LEU . 28.4 mmtp -104.86 -40.06 6.07 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.991 -173.107 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -132.02 145.63 51.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.145 -176.07 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.434 HG13 HD13 ' A' ' 11' ' ' LEU . 63.0 mt -96.66 128.13 48.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.87 -0.604 . . . . 0.0 109.731 173.117 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.3 t -89.26 -47.11 15.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.047 0.451 . . . . 0.0 109.965 -179.569 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.478 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.1 t0 -154.22 150.26 27.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.023 177.505 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.8 p -138.46 131.95 30.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.059 0.456 . . . . 0.0 110.743 179.356 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.4 t -104.74 126.9 52.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.482 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.2 m -53.91 -38.03 64.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.366 -171.712 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -151.92 127.82 10.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.225 0.536 . . . . 0.0 111.724 -178.648 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.424 HG22 ' CD2' ' A' ' 107' ' ' PHE . 94.9 t -145.15 136.99 20.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.542 -177.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -126.36 149.86 48.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.173 -178.178 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.682 ' CD2' HG21 ' A' ' 46' ' ' THR . 36.3 t80 -96.99 133.09 42.12 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.334 0.588 . . . . 0.0 111.788 -176.699 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -127.04 137.98 53.15 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.283 177.619 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.4 m -119.03 143.46 47.08 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 178.429 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -107.93 130.57 55.02 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.008 0.432 . . . . 0.0 110.246 177.45 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -101.76 113.74 27.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.063 176.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 86.1 p -70.88 -25.79 62.95 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -177.035 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.0 m -58.89 -36.4 74.61 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 121.121 -0.232 . . . . 0.0 111.244 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -113.95 -12.04 12.7 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -177.059 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 58.7 t30 69.74 50.51 0.49 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-O 121.704 0.764 . . . . 0.0 109.592 179.35 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.7 tp10 -148.01 146.93 29.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.908 -178.315 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.453 ' CB ' HD12 ' B' 1338 ' ' LEU . 83.7 m95 -89.2 141.0 28.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.176 176.651 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -121.42 126.31 49.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.229 -0.441 . . . . 0.0 109.916 176.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -73.17 135.14 44.6 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 177.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.682 HG21 ' CD2' ' A' ' 33' ' ' PHE . 67.9 p -92.35 162.1 14.4 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.24 -177.869 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -75.95 5.68 6.21 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.3 t -97.16 106.42 18.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 121.091 0.472 . . . . 0.0 110.29 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -131.73 115.5 16.09 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 176.164 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.5 38.96 Favored Glycine 0 CA--C 1.52 0.392 0 C-N-CA 120.063 -1.065 . . . . 0.0 112.392 -169.456 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.5 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -80.94 136.47 36.04 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.373 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -102.18 123.8 46.65 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -175.641 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.5 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 4.5 m-85 -128.53 140.92 51.55 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.644 0.259 . . . . 0.0 110.721 177.165 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.492 HD11 HG23 ' A' ' 116' ' ' ILE . 74.8 mt -101.63 127.35 55.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 170.71 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.591 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 11.2 m-30 -108.53 140.62 41.61 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.018 0.437 . . . . 0.0 111.665 -177.35 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -108.82 143.38 38.08 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.934 173.658 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -140.89 145.51 36.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.028 178.235 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -86.93 28.17 0.93 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.217 -0.447 . . . . 0.0 112.03 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.28 164.15 36.7 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -63.96 128.83 93.44 Favored Pre-proline 0 CA--C 1.539 0.557 0 CA-C-O 118.401 -0.809 . . . . 0.0 110.024 -177.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.61 140.9 69.9 Favored 'Cis proline' 0 N--CA 1.497 1.719 0 CA-C-N 121.909 1.717 . . . . 0.0 111.738 -1.312 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -63.97 -41.37 97.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.986 -177.569 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.442 ' HB3' HD12 ' A' ' 80' ' ' ILE . 73.9 m80 -143.15 137.94 29.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.315 0.579 . . . . 0.0 110.911 -177.233 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.0 t -150.04 151.63 33.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.421 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 56.7 mt -115.08 139.81 39.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.961 -177.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -131.79 142.09 49.65 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.082 -178.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.1 mt -119.84 126.69 75.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.207 0.527 . . . . 0.0 109.771 171.865 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -94.66 99.56 11.65 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.648 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -73.28 105.96 4.91 Favored 'General case' 0 C--N 1.332 -0.16 0 O-C-N 123.687 0.617 . . . . 0.0 110.934 -175.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 25.9 mmt85 -74.36 -40.48 62.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.447 -170.642 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 45.0 mt -74.07 -45.16 51.05 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.77 0.319 . . . . 0.0 111.411 -175.271 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 29.8 t-20 -95.04 -3.2 48.7 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -175.347 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.5 p 50.95 43.22 28.83 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.496 0.665 . . . . 0.0 111.147 178.11 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 37.2 m -122.97 142.94 50.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.143 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.2 p -91.83 127.97 37.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.29 -178.121 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -117.46 122.15 42.96 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 175.527 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 p -125.56 146.96 30.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-O 120.705 0.288 . . . . 0.0 111.08 -178.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -149.83 126.48 5.3 Favored Pre-proline 0 CA--C 1.539 0.546 0 CA-C-O 118.557 -0.735 . . . . 0.0 110.345 175.212 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -75.36 150.86 37.22 Favored 'Trans proline' 0 N--CA 1.498 1.765 0 C-N-CA 121.388 1.392 . . . . 0.0 112.105 177.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.442 HD12 ' HB3' ' A' ' 63' ' ' HIS . 63.1 mt -90.67 135.95 25.28 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 CA-C-O 120.937 0.399 . . . . 0.0 110.376 179.091 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.9 p -132.12 154.71 49.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.667 177.111 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -93.79 35.82 4.0 Favored Glycine 0 CA--C 1.525 0.68 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.048 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 46.7 p -111.0 -21.08 12.18 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 111.995 0.368 . . . . 0.0 111.995 174.724 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.6 mt -68.43 147.19 52.42 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-O 120.909 0.385 . . . . 0.0 111.367 -175.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.9 tt0 -114.31 135.82 53.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.768 176.309 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 60.4 mt -115.6 157.58 23.93 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.959 0.409 . . . . 0.0 110.882 -176.393 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -149.22 142.39 25.01 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 178.443 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.1 t -99.03 109.14 21.93 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.613 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -106.8 103.73 48.36 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 172.188 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -70.55 142.99 45.8 Favored 'Trans proline' 0 N--CA 1.497 1.72 0 CA-C-N 120.546 1.231 . . . . 0.0 112.138 -170.186 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -90.62 14.27 50.96 Favored 'Cis proline' 0 N--CA 1.5 1.901 0 CA-C-N 121.049 1.41 . . . . 0.0 113.534 -4.254 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -94.89 170.42 9.44 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 122.378 0.271 . . . . 0.0 110.758 -177.631 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 54.1 tp -116.1 133.2 56.28 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 173.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.8 tp -124.67 139.98 53.36 Favored 'General case' 0 C--N 1.334 -0.101 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 -173.878 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -144.5 153.09 41.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.972 0.415 . . . . 0.0 110.564 175.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.6 mtm180 -103.89 144.35 31.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.739 -177.257 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -127.57 163.05 25.02 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.893 0.854 . . . . 0.0 111.761 -176.485 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -47.84 149.24 1.35 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.14 -177.536 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 87.5 mtt-85 63.5 30.87 15.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.155 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 34.9 m 66.27 35.16 6.07 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.913 0.387 . . . . 0.0 111.628 165.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 40.3 mtp180 -99.87 147.32 25.65 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 82.9 mt -113.33 126.92 70.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -178.631 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -136.12 148.36 48.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.429 -178.397 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -144.73 169.3 26.62 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 120.771 -0.728 . . . . 0.0 111.651 -178.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -126.0 141.85 51.78 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.292 -0.454 . . . . 0.0 110.565 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 77.5 t90 -106.63 124.02 48.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.511 174.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.424 ' CD2' HG22 ' A' ' 31' ' ' VAL . 59.5 m-85 -109.65 140.19 43.78 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 123.312 0.383 . . . . 0.0 110.523 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -50.33 -37.13 35.15 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.845 178.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 39.1 t-20 -133.72 135.49 44.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.345 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.2 m -61.63 -42.77 99.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.056 -177.593 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -59.43 -43.64 93.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.373 0.606 . . . . 0.0 110.084 179.084 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -56.56 -43.7 80.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.133 178.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 51.4 t -59.31 -40.99 87.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.353 177.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -58.88 -44.57 91.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.8 0.333 . . . . 0.0 110.627 -177.561 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -59.99 -49.74 76.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.944 0.402 . . . . 0.0 110.649 -177.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.492 HG23 HD11 ' A' ' 54' ' ' ILE . 29.8 mm -58.46 -45.31 90.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.099 0.476 . . . . 0.0 110.067 -178.344 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 61.1 p -59.41 -43.03 93.1 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.73 -177.719 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.73 -43.99 94.3 Favored Glycine 0 CA--C 1.523 0.545 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 -178.878 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.478 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.8 mt -58.4 -48.21 81.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.074 0.464 . . . . 0.0 110.459 -178.732 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.442 ' HA ' HD12 ' A' ' 123' ' ' LEU . 55.4 t -59.0 -42.57 86.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.167 -179.225 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.467 ' HA ' HD12 ' A' ' 124' ' ' LEU . 26.6 m120 -57.38 -42.07 81.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.896 0.379 . . . . 0.0 110.605 -179.329 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -59.65 -44.63 96.72 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.442 HD12 ' HA ' ' A' ' 120' ' ' VAL . 58.0 mt -57.68 -42.99 84.74 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.98 0.419 . . . . 0.0 110.429 179.365 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.467 HD12 ' HA ' ' A' ' 121' ' ' ASN . 17.7 mt . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.548 179.121 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B 1338 ' ' LEU . . . . . 0.453 HD12 ' CB ' ' A' ' 43' ' ' TRP . 18.9 mt . . . . . 0 C--O 1.234 0.279 0 CA-C-O 118.461 -0.781 . . . . 0.0 109.488 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.21 139.65 15.04 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 CA-C-N 120.435 1.191 . . . . 0.0 111.083 174.088 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 19.8 mtmm -97.31 125.94 43.64 Favored Pre-proline 0 CA--C 1.535 0.401 0 CA-C-O 118.514 -0.755 . . . . 0.0 110.188 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -63.25 161.15 31.69 Favored 'Trans proline' 0 N--CA 1.498 1.759 0 CA-C-N 120.563 1.237 . . . . 0.0 111.553 176.045 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -49.19 157.04 2.07 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 121.38 1.386 . . . . 0.0 111.812 178.03 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B 1343 ' ' LEU . . . . . 0.531 ' H ' HD12 ' B' 1343 ' ' LEU . 6.2 mp -49.99 -25.58 3.47 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -176.492 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 68.8 t80 -55.95 -38.46 70.39 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.809 0.337 . . . . 0.0 111.084 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 50.5 t90 -60.88 -48.08 83.42 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.509 -176.473 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -63.61 -49.27 73.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.067 0.46 . . . . 0.0 110.785 -177.545 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -59.34 -43.86 92.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.926 -176.544 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -59.19 -48.32 82.04 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.638 -176.164 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.17 -49.12 78.87 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.733 -177.236 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 61.7 tt0 . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.226 -176.046 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.1 m . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.911 0.386 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 48.2 mm -59.81 -44.7 94.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.216 -178.271 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.0 m -59.58 -44.05 93.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.571 -177.828 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -59.92 -45.2 93.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.563 -178.48 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 87.8 mtp -58.26 -44.21 88.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.093 0.473 . . . . 0.0 110.458 -178.273 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -60.75 -49.18 78.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.296 -178.4 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.66 ' HA ' HD12 ' A' ' 14' ' ' ILE . 10.4 tp -59.75 -33.02 71.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.058 -178.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.34 -50.58 69.44 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.649 0.262 . . . . 0.0 110.851 179.517 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.96 -41.67 83.38 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.944 0.402 . . . . 0.0 110.404 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.677 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 93.9 mt -54.13 -52.98 32.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.724 178.577 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -51.93 -24.76 6.85 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -178.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 65.8 mmtt -59.24 -33.73 71.37 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -177.415 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.6 mm -109.77 -43.67 5.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.0 0.429 . . . . 0.0 110.071 -176.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -117.61 77.15 10.7 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.968 -178.634 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -55.2 -20.49 24.78 Favored 'Trans proline' 0 N--CA 1.497 1.731 0 C-N-CA 121.47 1.447 . . . . 0.0 113.531 -175.357 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.3 p90 -90.61 11.62 21.44 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -174.67 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -88.15 131.21 34.8 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 174.154 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.572 ' O ' HD21 ' A' ' 11' ' ' LEU . 99.1 mttt -108.31 -38.69 5.66 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.745 0.307 . . . . 0.0 111.145 -175.17 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -135.86 147.65 48.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.007 0.432 . . . . 0.0 111.183 -175.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.411 HD11 HD12 ' A' ' 14' ' ' ILE . 21.8 mt -99.39 134.28 39.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 171.752 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.6 t -92.83 -47.13 13.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.242 -0.435 . . . . 0.0 109.877 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.504 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.1 t0 -152.23 155.06 36.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.014 178.701 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.1 p -142.7 131.95 23.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.171 0.51 . . . . 0.0 110.895 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.6 t -107.27 126.58 52.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.695 177.299 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.7 t -54.38 -38.67 66.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.154 -172.309 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 -150.7 127.21 10.78 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.294 0.569 . . . . 0.0 111.689 -179.026 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.439 HG21 ' HB3' ' A' ' 52' ' ' PHE . 92.8 t -144.84 138.55 22.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.336 -178.094 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.59 149.81 50.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.303 -177.089 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -99.68 131.2 45.82 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.259 0.552 . . . . 0.0 111.833 -176.151 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -123.85 141.75 51.75 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.466 178.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 72.5 m -120.99 147.01 46.08 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.576 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -107.79 131.9 53.97 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.951 0.405 . . . . 0.0 110.416 175.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.6 t-20 -104.31 115.65 30.76 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.977 178.04 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 27.1 t -67.65 -33.12 74.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.9 -177.362 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.1 m -60.56 -39.79 89.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.752 0.31 . . . . 0.0 110.887 -177.39 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -93.13 -21.52 19.63 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 19.2 t30 69.13 42.69 1.2 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-O 121.288 0.566 . . . . 0.0 109.809 -177.661 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.0 mt-10 -151.34 164.17 37.29 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.156 -177.265 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.428 ' CB ' HD12 ' B' 1338 ' ' LEU . 83.9 m95 -94.12 141.66 28.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.352 177.537 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.9 tp10 -124.97 127.53 47.17 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 177.003 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.7 ttpp -73.64 139.15 45.25 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 177.758 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 52.4 p -92.23 172.23 8.55 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.071 -178.745 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -84.08 12.6 6.13 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 178.327 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.7 t -104.05 106.43 20.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-O 121.068 0.461 . . . . 0.0 110.346 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -132.22 114.43 14.45 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 176.338 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.59 176.51 38.91 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.022 -1.085 . . . . 0.0 112.3 -169.362 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.484 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -81.31 135.81 35.73 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 175.415 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.439 ' HB3' HG21 ' A' ' 31' ' ' VAL . 6.2 t80 -99.42 127.34 45.46 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.883 -0.327 . . . . 0.0 110.126 -176.544 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.484 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 7.4 m-85 -131.67 142.46 49.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.723 0.297 . . . . 0.0 110.339 177.294 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.673 HD11 HG23 ' A' ' 116' ' ' ILE . 68.6 mt -101.61 127.95 54.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 171.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.677 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.3 m-30 -108.53 135.55 49.61 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.855 0.36 . . . . 0.0 111.302 -175.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 68.8 t60 -109.71 143.28 39.72 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.104 174.207 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 60.5 ttt180 -141.92 146.75 36.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.233 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -86.88 28.11 0.93 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.112 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.7 166.16 33.53 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -63.99 127.64 92.03 Favored Pre-proline 0 CA--C 1.539 0.537 0 CA-C-O 118.445 -0.788 . . . . 0.0 110.066 -177.895 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -75.98 140.94 68.94 Favored 'Cis proline' 0 N--CA 1.497 1.702 0 CA-C-N 121.89 1.711 . . . . 0.0 111.765 -1.172 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -62.45 -42.26 99.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.945 -178.057 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.4 ' HB3' HD12 ' A' ' 80' ' ' ILE . 73.3 m80 -142.84 138.58 30.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.436 0.636 . . . . 0.0 110.891 -177.131 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.8 t -150.19 151.73 33.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.311 -178.024 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 47.7 mt -110.31 139.81 32.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -131.78 142.03 49.64 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.761 -176.746 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 59.7 mt -124.62 128.99 73.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.249 0.547 . . . . 0.0 110.06 173.166 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -96.26 99.54 11.24 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.53 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.2 t-20 -74.7 106.29 6.19 Favored 'General case' 0 C--N 1.331 -0.209 0 O-C-N 123.647 0.592 . . . . 0.0 110.933 -175.733 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 71.2 mtm180 -73.16 -43.91 60.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.588 -170.608 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 29.8 mt -72.56 -45.09 60.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.634 -174.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 37.2 t-20 -95.13 -3.11 48.57 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -174.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 73.0 p 50.73 42.9 28.0 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.478 0.656 . . . . 0.0 111.186 177.088 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.0 m -125.43 133.87 52.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.275 -179.349 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 80.4 p -80.16 130.45 35.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.301 -178.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -118.46 122.22 42.19 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 174.469 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 34.6 t -125.48 145.62 32.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-O 120.725 0.298 . . . . 0.0 110.674 -177.433 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -148.26 126.41 5.93 Favored Pre-proline 0 CA--C 1.538 0.492 0 CA-C-O 118.64 -0.695 . . . . 0.0 110.496 174.171 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -75.42 150.9 37.02 Favored 'Trans proline' 0 N--CA 1.5 1.875 0 C-N-CA 121.462 1.442 . . . . 0.0 112.184 177.578 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.4 HD12 ' HB3' ' A' ' 63' ' ' HIS . 66.5 mt -92.15 133.09 34.69 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.31 178.257 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.6 p -132.21 159.54 38.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.732 177.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -94.54 36.69 3.67 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.96 -178.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 51.7 p -111.07 -22.49 11.44 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 174.199 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.84 145.04 54.07 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-O 120.878 0.37 . . . . 0.0 111.251 -176.062 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 57.5 tt0 -116.93 135.78 53.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.729 175.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 63.2 mt -113.28 159.19 19.62 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.702 -176.418 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -150.02 143.94 25.49 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 178.522 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 29.3 t -99.59 109.15 21.68 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.462 -0.495 . . . . 0.0 110.326 178.081 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.404 ' HG3' HD22 ' A' ' 94' ' ' LEU . 19.3 mm-40 -106.83 103.75 48.55 Favored Pre-proline 0 C--N 1.329 -0.317 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 172.638 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -67.38 142.37 59.68 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 CA-C-N 120.491 1.211 . . . . 0.0 111.787 -172.138 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -90.76 12.73 55.38 Favored 'Cis proline' 0 N--CA 1.5 1.899 0 CA-C-N 121.146 1.445 . . . . 0.0 113.493 -4.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -94.9 170.17 9.62 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 122.304 0.242 . . . . 0.0 110.618 -176.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 58.0 tp -111.99 134.91 53.25 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 171.783 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.441 HD21 ' HZ2' ' B' 1345 ' ' TRP . 10.6 tp -126.88 139.65 52.92 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.5 0.191 . . . . 0.0 110.606 -173.395 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 50.9 p90 -145.5 156.81 43.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.798 0.332 . . . . 0.0 110.534 175.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.8 mtm105 -102.07 146.89 27.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.66 -178.368 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -126.47 163.81 22.52 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.591 0.71 . . . . 0.0 111.374 -177.188 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -47.16 144.86 2.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.192 -177.526 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 31.9 ttt85 65.27 30.92 11.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.416 -0.811 . . . . 0.0 112.021 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.5 p 65.59 35.24 7.22 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.871 0.367 . . . . 0.0 111.719 166.138 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 91.7 mtt-85 -98.0 152.74 18.95 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.363 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 78.3 mt -114.58 127.58 72.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -177.733 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -137.56 150.32 47.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.675 178.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.06 169.3 25.03 Favored Glycine 0 CA--C 1.522 0.53 0 N-CA-C 111.346 -0.702 . . . . 0.0 111.346 -176.262 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -125.3 139.78 53.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.902 0.382 . . . . 0.0 110.894 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 66.5 t90 -107.1 121.57 44.75 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.574 174.551 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.439 ' CD1' HG22 ' A' ' 31' ' ' VAL . 61.2 m-85 -111.74 140.19 46.58 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.131 0.269 . . . . 0.0 110.461 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -49.93 -37.72 33.03 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.793 178.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 46.3 t-20 -134.76 131.43 37.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.107 178.743 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.4 p -57.14 -38.24 73.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.884 -179.192 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -57.81 -44.84 86.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.524 0.678 . . . . 0.0 109.962 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -57.28 -45.28 84.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.026 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 47.5 t -59.3 -39.59 83.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.612 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -60.07 -46.26 90.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.908 0.385 . . . . 0.0 110.705 -177.208 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -59.96 -48.96 79.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.652 -177.407 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.673 HG23 HD11 ' A' ' 54' ' ' ILE . 31.7 mm -58.62 -44.74 90.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.037 -178.581 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 57.6 p -59.46 -43.82 93.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.739 -177.524 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.78 -44.74 94.08 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.687 -0.965 . . . . 0.0 110.687 -178.785 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.504 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.1 mt -58.32 -47.64 83.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.115 0.483 . . . . 0.0 110.501 -178.505 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 51.7 t -59.15 -43.41 89.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.137 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -57.25 -41.95 80.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.907 0.384 . . . . 0.0 110.673 -178.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.55 -46.27 94.64 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 -179.513 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 72.4 mt -58.55 -42.62 88.29 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.943 0.401 . . . . 0.0 110.662 -179.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 48.1 mt . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.82 -179.086 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B 1338 ' ' LEU . . . . . 0.428 HD12 ' CB ' ' A' ' 43' ' ' TRP . 13.5 mt . . . . . 0 CA--C 1.531 0.219 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -79.11 139.86 15.35 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 C-N-CA 121.229 1.286 . . . . 0.0 111.339 175.619 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 27.5 mmtp -97.13 125.76 44.69 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 118.889 -0.577 . . . . 0.0 110.225 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -74.09 155.72 47.33 Favored 'Trans proline' 0 N--CA 1.495 1.613 0 C-N-CA 121.429 1.419 . . . . 0.0 111.704 172.292 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -51.73 154.76 8.91 Favored 'Trans proline' 0 N--CA 1.494 1.554 0 C-N-CA 121.361 1.374 . . . . 0.0 111.783 178.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 26.0 tp -49.91 -29.17 7.76 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -177.241 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 64.7 t80 -54.93 -37.12 66.0 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.898 0.38 . . . . 0.0 111.228 -176.642 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B 1345 ' ' TRP . . . . . 0.441 ' HZ2' HD21 ' A' ' 94' ' ' LEU . 34.2 t90 -60.55 -48.14 83.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.261 -177.006 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -62.58 -48.8 77.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.119 0.485 . . . . 0.0 110.57 -177.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -59.2 -42.62 91.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.938 -176.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -59.12 -48.52 81.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.861 0.362 . . . . 0.0 110.594 -176.457 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.63 -48.94 79.71 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.601 -177.534 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.7 tt0 . . . . . 0 C--N 1.326 -0.431 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.174 -176.505 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.5 m . . . . . 0 CA--C 1.527 0.081 0 CA-C-O 120.899 0.38 . . . . 0.0 110.768 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mm -60.29 -47.08 93.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.991 0.424 . . . . 0.0 110.051 -178.791 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 35.3 m -58.98 -44.62 91.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.448 -177.755 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -59.22 -45.0 92.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.608 -178.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 44.1 ttm -58.34 -44.01 88.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.025 0.44 . . . . 0.0 110.319 -178.002 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 29.7 m120 -60.13 -49.62 76.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.271 -178.535 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.698 ' HA ' HD12 ' A' ' 14' ' ' ILE . 10.8 tp -59.62 -33.25 71.27 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.066 -178.84 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.04 -50.35 70.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.632 0.254 . . . . 0.0 110.798 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.04 -41.77 83.97 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.018 0.437 . . . . 0.0 110.455 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.698 HD12 ' HA ' ' A' ' 11' ' ' LEU . 94.9 mt -54.16 -52.96 32.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.66 178.406 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -52.51 -23.69 6.7 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -178.704 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.1 tttm -59.0 -33.65 70.95 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 -177.372 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.9 mm -109.89 -42.9 5.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.942 0.401 . . . . 0.0 110.204 -177.293 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -116.85 80.07 10.66 Favored Pre-proline 0 CA--C 1.535 0.375 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.341 -176.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -54.2 -22.59 26.43 Favored 'Trans proline' 0 N--CA 1.498 1.741 0 C-N-CA 121.533 1.489 . . . . 0.0 113.379 -176.129 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -92.1 14.42 16.04 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 -174.706 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -91.78 121.46 33.43 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 173.676 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.622 ' O ' HD21 ' A' ' 11' ' ' LEU . 22.9 tptm -104.37 -39.83 6.31 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.135 -172.794 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -134.31 147.72 50.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.099 -176.359 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.415 HD11 HD12 ' A' ' 14' ' ' ILE . 22.6 mt -99.6 133.25 43.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 172.869 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.8 t -92.48 -47.25 14.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.983 179.696 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.5 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.0 t0 -153.07 151.15 29.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.84 178.331 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.1 p -139.02 132.04 29.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.059 0.457 . . . . 0.0 110.925 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.6 t -106.28 125.83 51.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.63 176.623 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.7 m -54.04 -37.85 64.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.241 -173.042 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 64.6 t-80 -151.52 126.94 10.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.331 0.586 . . . . 0.0 111.737 -179.138 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.41 HG21 ' HB3' ' A' ' 52' ' ' PHE . 94.8 t -144.97 140.83 23.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.399 -178.128 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.48 149.92 51.05 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.211 -177.534 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -98.32 131.96 44.19 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.35 0.595 . . . . 0.0 111.889 -176.046 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -124.58 143.18 50.84 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.6 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 86.1 m -121.94 144.76 48.68 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -106.5 131.96 53.07 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.881 0.372 . . . . 0.0 110.116 175.832 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 -103.62 115.05 29.79 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.828 177.081 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.7 t -67.93 -32.56 73.1 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.958 -176.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.4 m -60.29 -39.06 85.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.663 0.268 . . . . 0.0 110.996 -177.363 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -95.82 -21.46 18.09 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.601 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 69.71 44.37 0.87 Allowed 'General case' 0 C--O 1.232 0.181 0 CA-C-O 121.402 0.62 . . . . 0.0 109.697 -178.02 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -150.4 162.68 40.09 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.143 -177.705 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.413 ' CB ' HD12 ' B' 1338 ' ' LEU . 85.3 m95 -94.94 140.08 30.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.403 178.24 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -122.26 130.33 53.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.076 177.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.9 pttp -75.43 139.27 42.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.293 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.7 p -92.33 169.4 10.61 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.651 -0.419 . . . . 0.0 109.95 178.229 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.1 p30 -85.79 13.11 7.73 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 177.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 40.2 t -104.11 106.44 20.32 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-O 121.025 0.441 . . . . 0.0 110.313 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -130.76 114.59 15.54 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 176.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -161.94 176.47 38.38 Favored Glycine 0 CA--C 1.519 0.338 0 C-N-CA 120.099 -1.048 . . . . 0.0 112.451 -169.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.517 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -79.71 136.28 36.74 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 175.398 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.41 ' HB3' HG21 ' A' ' 31' ' ' VAL . 4.8 t80 -101.44 123.5 45.6 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 120.952 -0.299 . . . . 0.0 110.23 -176.34 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.517 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 5.0 m-85 -128.25 141.16 51.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.629 0.252 . . . . 0.0 110.658 177.057 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.425 HD11 HG23 ' A' ' 116' ' ' ILE . 74.6 mt -101.5 127.06 55.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 171.325 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.627 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 12.3 m-30 -108.55 138.94 44.03 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.956 0.408 . . . . 0.0 111.346 -177.393 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 61.5 t60 -108.81 143.38 38.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.912 174.235 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 64.3 ttt180 -140.47 145.85 37.46 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.025 177.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.9 m120 -86.97 28.18 0.94 Allowed 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.268 -0.423 . . . . 0.0 112.045 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.31 166.09 33.17 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 179.274 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -64.05 127.91 92.4 Favored Pre-proline 0 CA--C 1.54 0.574 0 CA-C-O 118.463 -0.779 . . . . 0.0 109.949 -177.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -75.66 140.98 69.52 Favored 'Cis proline' 0 N--CA 1.497 1.702 0 CA-C-N 121.835 1.691 . . . . 0.0 111.741 -1.204 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -62.73 -41.87 99.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.955 -177.733 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.403 ' HB3' HD12 ' A' ' 80' ' ' ILE . 73.5 m80 -143.25 139.55 30.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.359 0.6 . . . . 0.0 110.908 -177.079 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.4 t -149.99 151.76 33.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.345 -178.044 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 51.7 mt -114.68 138.92 43.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 -177.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -131.82 142.16 49.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.391 -178.043 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.5 mt -121.07 129.63 75.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.248 0.547 . . . . 0.0 109.738 172.836 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -97.21 99.54 11.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.492 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -73.31 106.06 4.97 Favored 'General case' 0 C--N 1.332 -0.188 0 O-C-N 123.702 0.626 . . . . 0.0 111.013 -175.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.2 ttm180 -72.85 -43.39 62.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.416 -171.114 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 52.6 mt -70.3 -45.25 66.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.605 -174.634 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 39.0 m-20 -95.1 -3.17 48.57 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -175.892 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 67.4 p 51.63 43.15 30.01 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.55 0.69 . . . . 0.0 110.996 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.1 m -124.85 142.02 51.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.277 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.3 p -88.58 133.66 34.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.389 -178.172 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -123.69 122.09 37.19 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 175.3 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.8 p -125.57 147.34 30.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 120.836 0.35 . . . . 0.0 111.109 -178.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -149.8 126.49 5.31 Favored Pre-proline 0 CA--C 1.539 0.534 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.203 175.214 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -75.39 150.91 37.17 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 121.371 1.38 . . . . 0.0 112.067 178.082 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.403 HD12 ' HB3' ' A' ' 63' ' ' HIS . 64.9 mt -89.78 115.81 30.03 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.328 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 66.0 p -97.92 159.01 15.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.94 176.643 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -95.4 24.96 26.79 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.817 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.3 p -111.07 -10.9 14.33 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 175.196 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.0 mt -67.96 135.16 51.94 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.856 0.36 . . . . 0.0 111.423 -175.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -111.05 135.92 50.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.768 175.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 66.6 mt -113.91 161.15 17.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.998 0.428 . . . . 0.0 111.056 -175.52 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -150.04 140.93 22.82 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 177.088 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.2 t -102.27 109.2 20.81 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.582 -0.447 . . . . 0.0 111.046 -178.722 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -106.82 103.75 48.52 Favored Pre-proline 0 C--N 1.329 -0.301 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 170.819 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -69.56 141.85 47.16 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 CA-C-N 120.654 1.269 . . . . 0.0 111.811 -172.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -90.08 11.94 57.5 Favored 'Cis proline' 0 N--CA 1.499 1.816 0 CA-C-N 121.068 1.417 . . . . 0.0 113.628 -3.453 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -90.86 169.54 10.84 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.686 0.279 . . . . 0.0 110.765 -178.181 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 50.7 tp -118.77 134.66 54.98 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 171.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.434 HD11 ' CG2' ' A' ' 102' ' ' ILE . 9.3 tp -125.58 140.37 52.79 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.637 0.256 . . . . 0.0 110.426 -175.441 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 22.2 p90 -145.42 155.09 42.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.787 0.327 . . . . 0.0 110.239 175.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.1 mtm105 -101.98 147.75 26.18 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.877 0.37 . . . . 0.0 110.624 -177.727 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -128.85 165.65 20.58 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.731 0.777 . . . . 0.0 111.523 -176.818 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -47.11 146.93 1.6 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.553 -0.748 . . . . 0.0 112.285 -177.378 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 63.33 30.92 15.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.227 179.707 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.5 p 66.26 35.25 6.05 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.729 0.3 . . . . 0.0 111.685 166.174 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -98.87 152.78 19.37 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.829 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.434 ' CG2' HD11 ' A' ' 94' ' ' LEU . 86.5 mt -115.46 126.96 73.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -178.15 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -133.92 150.24 51.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.58 178.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.6 167.38 25.89 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 111.351 -0.7 . . . . 0.0 111.351 -176.218 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -125.38 139.53 53.59 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.517 -0.341 . . . . 0.0 110.663 -179.098 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 7.6 t90 -107.16 125.72 51.46 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.417 174.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -113.52 141.8 46.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.792 0.329 . . . . 0.0 110.625 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -51.43 -35.32 38.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.691 178.246 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.2 t-20 -137.38 136.75 38.17 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.755 0.312 . . . . 0.0 110.403 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 25.1 m -61.38 -42.56 98.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.107 -177.12 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -57.84 -43.2 85.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.368 0.604 . . . . 0.0 110.106 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -57.03 -45.9 82.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.869 178.58 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 43.0 t -59.6 -37.74 79.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.889 178.623 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -61.73 -50.08 73.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.656 0.265 . . . . 0.0 110.856 -175.741 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -61.65 -44.75 96.38 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.987 -176.429 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.496 ' HA ' HD12 ' A' ' 119' ' ' LEU . 23.1 mm -59.52 -46.86 92.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 19.3 m -58.55 -44.62 89.71 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.563 -177.197 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.39 -43.33 93.91 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 -178.871 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.5 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.7 mt -58.25 -49.45 77.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.143 0.497 . . . . 0.0 110.489 -178.705 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 54.5 t -58.8 -43.87 89.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.171 -177.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -59.05 -42.3 89.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.825 -178.539 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.94 -41.94 99.7 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 111.407 -0.677 . . . . 0.0 111.407 -178.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 20.8 mt -63.67 -43.54 96.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.788 0.328 . . . . 0.0 111.181 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 66.9 mt . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.437 -176.483 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B 1338 ' ' LEU . . . . . 0.413 HD12 ' CB ' ' A' ' 43' ' ' TRP . 16.1 mt . . . . . 0 C--O 1.234 0.259 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -79.14 139.82 15.26 Favored 'Trans proline' 0 N--CA 1.491 1.351 0 C-N-CA 121.166 1.244 . . . . 0.0 111.215 174.547 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -97.2 125.78 44.46 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-O 118.796 -0.621 . . . . 0.0 109.861 178.12 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -75.09 163.43 35.15 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 121.425 1.417 . . . . 0.0 111.694 173.008 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.56 157.2 32.9 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 121.341 1.36 . . . . 0.0 111.341 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 26.4 tp -50.06 -27.61 5.85 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -176.486 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -54.61 -36.7 64.74 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.867 0.365 . . . . 0.0 111.294 -177.78 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 39.2 t90 -61.08 -48.13 83.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.247 -177.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -61.2 -46.35 90.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.051 0.453 . . . . 0.0 110.477 -178.27 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -59.35 -44.71 92.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.722 -177.777 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -58.28 -46.33 86.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.451 -176.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.07 -47.74 84.6 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.631 -178.281 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.2 tt0 . . . . . 0 C--N 1.326 -0.414 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.951 -177.123 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.5 p . . . . . 0 CA--C 1.527 0.084 0 CA-C-O 120.756 0.312 . . . . 0.0 110.941 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 43.7 mm -62.29 -40.78 89.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.372 179.23 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.9 m -63.49 -49.97 71.47 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.679 -176.845 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.7 ptt180 -61.88 -37.45 84.61 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.799 -178.665 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 44.0 ttm -58.68 -46.21 87.72 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.151 0.5 . . . . 0.0 110.143 179.252 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -59.67 -48.92 79.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.195 -178.517 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.687 ' HA ' HD12 ' A' ' 14' ' ' ILE . 9.3 tp -59.74 -32.97 71.06 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.651 -0.419 . . . . 0.0 111.177 -178.831 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.84 -50.53 70.59 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.654 0.264 . . . . 0.0 110.701 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.64 -41.74 86.7 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.43 179.244 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.687 HD12 ' HA ' ' A' ' 11' ' ' LEU . 95.3 mt -54.19 -52.94 33.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.649 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -54.15 -21.6 9.17 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -178.404 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -58.64 -33.96 70.66 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 111.727 0.269 . . . . 0.0 111.727 -178.023 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.699 HG21 ' CB ' ' A' ' 75' ' ' SER . 46.6 mm -113.0 -40.15 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-O 120.722 0.296 . . . . 0.0 110.531 -177.015 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -117.05 77.38 8.99 Favored Pre-proline 0 CA--C 1.535 0.368 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.214 -178.29 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -55.39 -20.71 26.86 Favored 'Trans proline' 0 N--CA 1.498 1.76 0 C-N-CA 121.536 1.49 . . . . 0.0 113.459 -175.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.8 p90 -90.77 9.94 28.04 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -174.417 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -84.62 122.32 28.88 Favored 'General case' 0 C--O 1.231 0.11 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 174.292 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.409 ' O ' HD21 ' A' ' 11' ' ' LEU . 31.4 ttpt -97.49 -40.54 8.61 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.887 -173.841 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -148.44 153.06 38.0 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.586 -0.445 . . . . 0.0 111.433 -178.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 29.9 mt -94.38 138.3 20.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.848 178.353 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.2 t -92.58 -47.17 14.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.839 177.46 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.502 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.9 t0 -152.88 155.06 36.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.019 178.381 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.8 p -141.86 132.02 24.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.044 0.449 . . . . 0.0 110.943 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.5 t -108.49 126.45 52.93 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.647 177.16 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.4 t -54.58 -38.85 67.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.28 -172.627 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -150.45 126.8 10.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.225 0.536 . . . . 0.0 111.558 -179.079 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.456 HG22 ' CD2' ' A' ' 107' ' ' PHE . 96.2 t -145.19 140.43 22.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.309 -177.672 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.64 149.76 51.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.725 0.298 . . . . 0.0 111.314 -177.661 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.511 ' HD2' HG21 ' A' ' 46' ' ' THR . 36.4 t80 -98.63 130.83 45.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.27 -177.7 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -125.31 142.08 51.71 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.599 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.579 HG23 ' CZ ' ' A' ' 103' ' ' ARG . 64.1 m -120.38 145.86 46.75 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 178.342 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -108.27 131.87 54.26 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 121.011 0.434 . . . . 0.0 110.433 176.295 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -104.11 115.45 30.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.888 177.253 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.0 t -67.63 -32.51 73.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.918 -177.307 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.1 t -60.44 -40.26 90.44 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.726 0.298 . . . . 0.0 110.82 -177.15 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 98.0 mm-40 -93.8 -21.36 19.34 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.3 t30 69.66 43.48 0.98 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-O 121.436 0.636 . . . . 0.0 109.803 -177.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -151.51 162.97 40.05 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.037 -177.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.456 ' CB ' HD12 ' B' 1338 ' ' LEU . 89.0 m95 -94.33 141.76 28.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.336 177.507 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -124.01 130.42 52.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 0.0 109.958 176.039 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -72.42 139.21 47.65 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 177.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.511 HG21 ' HD2' ' A' ' 33' ' ' PHE . 77.3 p -92.35 179.04 5.66 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.298 -178.878 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -88.67 15.17 8.57 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -179.081 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.4 t -111.88 106.42 20.73 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 CA-C-O 120.982 0.42 . . . . 0.0 110.273 178.65 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -132.19 112.93 12.7 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 174.665 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.52 38.96 Favored Glycine 0 CA--C 1.52 0.4 0 C-N-CA 120.202 -0.999 . . . . 0.0 112.213 -168.783 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.478 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.47 135.95 37.49 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 174.647 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.419 ' HB3' HG21 ' A' ' 31' ' ' VAL . 6.3 t80 -101.26 127.04 48.03 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.346 -175.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.478 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 6.5 m-85 -130.76 142.09 50.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.765 0.316 . . . . 0.0 110.308 177.143 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.699 HD11 HG23 ' A' ' 116' ' ' ILE . 66.3 mt -101.62 127.58 54.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 172.616 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.672 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.2 m-30 -108.48 137.62 46.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.997 0.427 . . . . 0.0 111.208 -175.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 30.1 t60 -116.7 143.31 45.79 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.967 175.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -141.22 147.43 38.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.141 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -86.9 28.1 0.93 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.275 -0.421 . . . . 0.0 112.125 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.72 160.5 37.97 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 178.794 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -64.05 131.78 95.08 Favored Pre-proline 0 CA--C 1.539 0.547 0 CA-C-O 118.536 -0.745 . . . . 0.0 110.04 -176.76 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -71.13 140.88 67.16 Favored 'Cis proline' 0 N--CA 1.498 1.792 0 CA-C-N 121.701 1.643 . . . . 0.0 111.515 -1.586 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -65.22 -42.73 93.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.028 -177.296 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -143.52 140.97 30.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.494 0.664 . . . . 0.0 111.038 -177.078 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.3 t -150.42 152.39 34.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.211 -178.024 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 46.5 mt -112.58 138.13 42.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -178.371 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 79.2 t80 -131.83 142.02 49.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.972 -176.751 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.0 mt -123.62 133.23 69.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.18 0.514 . . . . 0.0 109.847 172.674 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -99.16 99.55 10.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.37 179.384 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -72.42 106.95 4.74 Favored 'General case' 0 C--N 1.332 -0.193 0 O-C-N 123.666 0.604 . . . . 0.0 111.092 -175.151 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 55.6 ttp180 -72.86 -41.04 65.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.198 -171.583 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 75.5 mt -70.51 -45.16 66.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.684 -175.109 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -95.01 -3.34 48.57 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -175.083 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.43 HG22 ' O ' ' A' ' 73' ' ' THR . 13.0 m 55.87 43.1 28.11 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 121.452 0.644 . . . . 0.0 110.57 177.064 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.6 m -131.78 149.03 52.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.229 -178.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.699 ' CB ' HG21 ' A' ' 17' ' ' ILE . 4.0 p -101.71 141.82 33.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.929 0.395 . . . . 0.0 110.933 -179.087 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -135.45 122.13 20.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.231 178.457 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.8 p -125.49 148.53 30.02 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-O 120.807 0.337 . . . . 0.0 111.035 -177.763 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -147.17 136.27 11.48 Favored Pre-proline 0 CA--C 1.537 0.456 0 CA-C-O 119.03 -0.509 . . . . 0.0 110.487 174.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.51 150.87 36.61 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 121.673 1.582 . . . . 0.0 112.411 179.453 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 68.8 mt -89.96 137.25 21.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.902 0.382 . . . . 0.0 110.165 177.118 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 61.6 p -132.15 159.47 38.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.866 177.957 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -95.79 36.04 4.03 Favored Glycine 0 CA--C 1.524 0.653 0 C-N-CA 120.845 -0.693 . . . . 0.0 111.914 -178.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.2 t -109.22 -21.97 12.31 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 174.598 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 74.8 mt -68.49 144.93 54.47 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-O 120.949 0.404 . . . . 0.0 111.492 -176.149 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 54.2 tt0 -114.78 135.87 53.71 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.715 175.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 67.6 mt -115.16 158.09 22.72 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.057 0.456 . . . . 0.0 111.11 -175.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -149.54 141.02 23.34 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 177.813 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.4 t -98.13 109.09 21.9 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.399 -0.521 . . . . 0.0 110.578 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -106.83 103.68 48.22 Favored Pre-proline 0 C--N 1.328 -0.355 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 172.118 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -71.41 142.22 40.41 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 CA-C-N 120.596 1.249 . . . . 0.0 112.025 -171.504 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -90.56 13.72 52.58 Favored 'Cis proline' 0 N--CA 1.499 1.844 0 CA-C-N 121.075 1.42 . . . . 0.0 113.541 -3.752 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -93.04 172.98 7.97 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 122.149 0.179 . . . . 0.0 110.721 -177.689 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 58.7 tp -115.94 135.7 53.73 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 171.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.2 tp -127.15 139.63 52.83 Favored 'General case' 0 C--N 1.334 -0.096 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 -174.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 9.4 p90 -148.84 153.79 38.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.951 0.405 . . . . 0.0 110.659 176.442 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 31.6 mtm180 -102.43 149.21 24.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.81 -176.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -129.73 166.53 19.68 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.791 0.805 . . . . 0.0 111.464 -177.679 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -47.77 145.01 3.01 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.249 -176.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 65.24 31.01 11.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.093 179.251 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 37.8 t 66.29 35.14 6.06 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.912 0.387 . . . . 0.0 111.578 166.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -98.25 152.77 19.06 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 179.22 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 78.0 mt -115.77 126.28 73.24 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 CA-C-O 121.061 0.458 . . . . 0.0 109.993 -177.122 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ARG . . . . . 0.579 ' CZ ' HG23 ' A' ' 35' ' ' THR . 85.7 mmt-85 -127.95 149.4 50.35 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.276 178.123 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -140.54 164.69 26.27 Favored Glycine 0 CA--C 1.522 0.517 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 -178.545 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 32.9 m-85 -125.35 136.65 53.67 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.442 -0.379 . . . . 0.0 110.856 -178.453 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -107.41 126.35 52.38 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.735 175.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.456 ' CD2' HG22 ' A' ' 31' ' ' VAL . 62.8 m-85 -117.84 142.67 47.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.799 0.333 . . . . 0.0 110.51 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -51.15 -34.72 32.37 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.769 178.252 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -137.62 136.92 37.96 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.767 0.318 . . . . 0.0 110.469 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.0 p -61.69 -40.48 95.15 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.161 -177.739 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -59.72 -43.67 94.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.407 0.622 . . . . 0.0 110.095 178.355 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -56.73 -45.32 82.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.979 179.265 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 43.0 t -60.22 -39.69 87.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.728 178.782 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -59.21 -45.65 90.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.77 0.319 . . . . 0.0 110.562 -176.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -60.62 -49.04 79.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.744 -177.528 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.699 HG23 HD11 ' A' ' 54' ' ' ILE . 31.6 mm -58.46 -44.98 90.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.039 -178.374 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 68.1 p -59.74 -44.37 93.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.767 -177.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.7 -43.79 94.32 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 110.678 -0.969 . . . . 0.0 110.678 -178.739 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.502 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.2 mt -59.06 -48.72 80.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.034 0.445 . . . . 0.0 110.506 -178.323 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.403 HG12 HD11 ' A' ' 124' ' ' LEU . 53.3 t -58.82 -43.24 87.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.168 -178.502 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -57.97 -43.0 86.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.681 -178.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.5 -42.77 99.67 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.407 -0.677 . . . . 0.0 111.407 -178.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 34.4 mt -63.94 -40.74 97.14 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.765 0.317 . . . . 0.0 111.403 -179.615 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.403 HD11 HG12 ' A' ' 120' ' ' VAL . 29.8 mt . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.687 -176.616 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1338 ' ' LEU . . . . . 0.456 HD12 ' CB ' ' A' ' 43' ' ' TRP . 15.4 mt . . . . . 0 C--O 1.233 0.228 0 CA-C-O 119.406 -0.331 . . . . 0.0 110.123 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.05 139.96 15.51 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 C-N-CA 121.154 1.236 . . . . 0.0 111.145 174.138 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -97.12 125.83 44.47 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-O 118.782 -0.628 . . . . 0.0 109.97 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -77.79 154.9 30.57 Favored 'Trans proline' 0 N--CA 1.494 1.52 0 C-N-CA 121.415 1.41 . . . . 0.0 111.438 173.353 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -50.54 151.18 10.64 Favored 'Trans proline' 0 N--CA 1.496 1.647 0 C-N-CA 121.263 1.309 . . . . 0.0 111.747 178.667 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 79.5 mt -49.94 -25.83 3.62 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 -177.089 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -55.54 -38.49 69.35 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.904 0.383 . . . . 0.0 111.059 -177.091 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 33.3 t90 -61.81 -48.11 82.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.269 -176.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -61.37 -48.2 82.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.073 0.463 . . . . 0.0 110.532 -177.122 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -59.86 -45.32 92.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 -177.111 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -58.76 -46.45 87.44 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.669 -176.45 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.53 -48.43 81.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.765 -177.534 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.104 -176.53 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.8 t . . . . . 0 N--CA 1.46 0.073 0 CA-C-O 120.892 0.377 . . . . 0.0 110.659 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.0 mm -60.09 -45.71 95.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.215 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.2 m -59.24 -45.66 90.57 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.024 0.44 . . . . 0.0 110.509 -177.607 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -59.38 -44.57 92.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.574 -178.692 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 44.5 ttm -58.26 -43.53 87.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.102 0.477 . . . . 0.0 110.463 -178.356 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -60.06 -49.5 77.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.299 -178.315 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.751 ' HA ' HD12 ' A' ' 14' ' ' ILE . 13.7 tp -61.32 -30.86 70.76 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.394 -179.144 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.85 -50.17 71.99 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.745 0.307 . . . . 0.0 110.619 178.102 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.44 -41.49 85.24 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.945 0.402 . . . . 0.0 110.392 178.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.751 HD12 ' HA ' ' A' ' 11' ' ' LEU . 95.5 mt -54.22 -52.95 33.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.659 178.771 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -53.3 -24.29 11.29 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -178.542 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -59.87 -33.52 71.93 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -177.319 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.5 mm -108.34 -40.69 4.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.787 0.327 . . . . 0.0 110.532 -176.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -114.78 84.94 10.89 Favored Pre-proline 0 CA--C 1.533 0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.713 -176.198 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -53.51 -22.97 23.33 Favored 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 121.522 1.482 . . . . 0.0 113.194 -178.121 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.4 p90 -97.98 22.06 9.84 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -175.352 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -101.81 121.23 41.7 Favored 'General case' 0 C--O 1.231 0.105 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 171.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.483 ' O ' HD21 ' A' ' 11' ' ' LEU . 51.1 tptt -110.95 -38.15 5.18 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.761 0.315 . . . . 0.0 111.272 -173.844 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -130.02 144.82 51.54 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.808 -176.646 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.471 HG13 HD13 ' A' ' 11' ' ' LEU . 59.4 mt -98.7 129.21 49.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.83 173.944 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.1 t -90.46 -47.11 14.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 0.0 109.914 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.494 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -153.37 152.13 30.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.129 178.322 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.7 p -140.82 131.96 26.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.992 0.425 . . . . 0.0 110.775 178.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.9 t -107.02 129.18 54.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.901 177.063 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.3 m -54.41 -38.3 66.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.269 -172.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 -152.41 127.53 9.77 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.323 0.583 . . . . 0.0 111.91 -178.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.469 HG22 ' CD2' ' A' ' 107' ' ' PHE . 98.4 t -145.2 140.69 22.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.466 -178.089 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.41 149.83 50.38 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.159 -178.079 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -97.03 132.78 42.49 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.204 0.526 . . . . 0.0 111.723 -177.359 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -128.16 142.85 51.06 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.668 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.3 m -121.5 148.09 44.92 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 177.192 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -112.48 131.69 55.45 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-O 120.865 0.364 . . . . 0.0 110.357 177.278 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -102.01 113.78 27.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.775 176.332 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 85.6 p -68.56 -31.02 69.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.074 -177.018 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.2 m -62.6 -38.58 90.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.667 0.27 . . . . 0.0 110.928 -177.721 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -94.68 -21.41 18.79 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -178.646 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 69.58 45.66 0.78 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.463 0.649 . . . . 0.0 109.434 -177.692 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 -151.89 149.69 29.24 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.233 -177.088 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.458 ' CB ' HD12 ' B' 1338 ' ' LEU . 82.7 m95 -86.98 142.46 27.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.199 176.57 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -123.78 126.29 46.21 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 175.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -75.51 140.35 42.73 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 178.574 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.8 p -92.29 170.72 9.57 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.144 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -84.37 12.43 6.77 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 178.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 40.4 t -104.39 106.48 20.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-O 120.969 0.414 . . . . 0.0 110.215 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -130.7 116.1 17.57 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 176.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.55 176.39 38.89 Favored Glycine 0 CA--C 1.521 0.443 0 C-N-CA 120.081 -1.056 . . . . 0.0 112.441 -169.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.476 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -80.22 136.63 36.51 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 175.254 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.401 ' HB3' HG21 ' A' ' 31' ' ' VAL . 4.5 t80 -101.8 125.31 48.44 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.293 -175.37 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.476 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 4.9 m-85 -129.46 141.57 50.99 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.791 0.329 . . . . 0.0 110.712 177.015 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.614 HD11 HG23 ' A' ' 116' ' ' ILE . 67.9 mt -101.58 126.38 55.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 171.806 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.654 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 11.6 m-30 -108.57 138.05 45.51 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.892 0.377 . . . . 0.0 111.335 -177.261 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 61.9 t60 -111.6 143.25 42.78 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.871 173.49 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 13.4 tpt180 -142.22 147.71 36.97 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.884 177.206 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -86.9 28.18 0.93 Allowed 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.73 171.3 20.33 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.1 mp0 -63.99 124.38 85.01 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.003 -178.729 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -79.41 140.97 59.01 Favored 'Cis proline' 0 N--CA 1.497 1.685 0 CA-C-N 121.937 1.728 . . . . 0.0 111.926 -0.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -63.2 -44.26 95.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.941 -177.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -143.32 135.86 27.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.307 0.575 . . . . 0.0 110.837 -177.475 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.4 t -149.6 150.91 32.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.572 -177.305 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.466 HG13 HD11 ' A' ' 80' ' ' ILE . 57.7 mt -114.32 137.46 47.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 -178.255 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -131.94 142.16 49.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.581 -177.373 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.5 mt -120.05 129.41 75.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.247 0.546 . . . . 0.0 109.729 172.379 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -96.58 99.52 11.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.531 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.2 t-20 -71.23 105.45 3.45 Favored 'General case' 0 N--CA 1.462 0.151 0 O-C-N 123.642 0.589 . . . . 0.0 110.971 -175.66 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -73.1 -42.43 62.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.235 -171.052 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 60.4 mt -70.9 -45.21 64.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.624 -174.526 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 54.8 m-20 -95.11 -3.27 48.36 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -175.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.0 m 55.71 43.52 27.83 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 121.452 0.644 . . . . 0.0 110.452 177.646 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.6 m -125.16 148.87 48.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.52 -178.204 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.3 p -97.3 132.53 42.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.346 -179.498 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -123.59 122.1 37.29 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.35 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.8 p -125.54 147.68 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-O 120.751 0.31 . . . . 0.0 111.237 -178.716 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -149.77 126.55 5.34 Favored Pre-proline 0 CA--C 1.537 0.473 0 CA-C-O 118.665 -0.684 . . . . 0.0 110.213 174.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -75.27 150.94 37.71 Favored 'Trans proline' 0 N--CA 1.498 1.765 0 C-N-CA 121.46 1.44 . . . . 0.0 112.265 178.161 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.466 HD11 HG13 ' A' ' 65' ' ' ILE . 67.0 mt -90.65 138.92 18.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.929 0.395 . . . . 0.0 110.302 178.546 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.4 p -132.1 155.65 47.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.706 177.118 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -94.04 36.68 3.65 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.002 -178.411 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.9 m -111.12 -22.97 11.17 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 173.715 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.7 mt -69.13 146.44 52.51 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 120.898 0.38 . . . . 0.0 111.373 -176.07 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.3 tt0 -115.78 135.93 53.54 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.662 175.499 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.1 mt -112.03 158.58 19.38 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.07 0.462 . . . . 0.0 111.058 -176.366 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -147.87 140.22 24.4 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.957 -0.756 . . . . 0.0 108.957 177.003 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.1 t -106.94 109.34 21.21 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.386 -177.522 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -106.83 103.68 48.25 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 169.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.1 145.25 78.48 Favored 'Trans proline' 0 N--CA 1.498 1.779 0 CA-C-N 120.391 1.175 . . . . 0.0 112.037 -170.061 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -92.61 17.53 41.6 Favored 'Cis proline' 0 N--CA 1.499 1.84 0 CA-C-N 120.893 1.355 . . . . 0.0 113.346 -3.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -104.89 162.11 13.61 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 110.337 -0.246 . . . . 0.0 110.337 -177.042 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 32.8 tp -115.72 133.48 55.99 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 122.062 -0.399 . . . . 0.0 111.177 -179.379 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.47 HD11 ' CG2' ' A' ' 102' ' ' ILE . 9.5 tp -122.53 140.42 52.79 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.252 -175.086 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -142.89 154.96 44.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.768 0.318 . . . . 0.0 110.492 176.542 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.8 mtm105 -101.96 146.65 27.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.71 -178.209 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -127.14 163.4 23.9 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.668 0.746 . . . . 0.0 111.414 -177.092 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 31.6 mp0 -48.33 147.17 2.44 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.112 -177.062 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 64.31 30.96 13.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.118 -0.946 . . . . 0.0 112.176 179.535 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 48.9 m 67.29 35.24 4.48 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.901 0.381 . . . . 0.0 111.631 165.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -99.82 151.36 21.37 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 178.555 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.575 HD13 ' CH2' ' B' 1345 ' ' TRP . 76.4 mt -114.71 126.51 72.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -178.504 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -137.21 149.72 47.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.13 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -147.39 169.42 28.34 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.001 -175.341 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -125.16 136.81 53.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.364 -0.418 . . . . 0.0 110.415 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 46.2 t90 -104.47 125.17 50.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.509 176.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.469 ' CD2' HG22 ' A' ' 31' ' ' VAL . 77.4 m-85 -112.22 140.91 46.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.733 -177.607 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -51.49 -40.78 60.21 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.81 179.154 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -129.06 136.55 50.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.671 0.272 . . . . 0.0 110.462 -179.481 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.2 p -63.14 -41.52 99.3 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.309 -177.571 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -60.38 -44.81 95.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.514 0.673 . . . . 0.0 109.985 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -55.98 -43.48 77.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.206 178.206 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 51.6 t -59.35 -41.46 89.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.527 177.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -58.65 -44.59 90.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.618 -176.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -60.56 -49.33 77.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.748 -177.606 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.614 HG23 HD11 ' A' ' 54' ' ' ILE . 30.4 mm -58.29 -45.91 89.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.099 0.476 . . . . 0.0 110.077 -178.109 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 78.0 p -59.99 -43.5 95.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.702 -177.505 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.66 -43.27 94.44 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.68 -0.968 . . . . 0.0 110.68 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.494 HD13 ' HB2' ' A' ' 26' ' ' ASP . 10.6 mt -59.83 -49.8 76.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.017 0.436 . . . . 0.0 110.686 -178.036 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 59.0 t -59.01 -42.67 86.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.148 -178.325 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -58.45 -43.03 88.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.861 0.362 . . . . 0.0 110.639 -178.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.25 -40.58 98.78 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.335 -0.706 . . . . 0.0 111.335 -179.103 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 34.8 mt -63.08 -42.97 99.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.794 0.33 . . . . 0.0 111.077 178.734 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 40.5 mt . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.435 -177.061 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B 1338 ' ' LEU . . . . . 0.458 HD12 ' CB ' ' A' ' 43' ' ' TRP . 13.9 mt . . . . . 0 CA--C 1.531 0.231 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -79.14 139.9 15.32 Favored 'Trans proline' 0 N--CA 1.491 1.361 0 C-N-CA 121.182 1.255 . . . . 0.0 111.221 174.365 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -97.06 125.77 44.78 Favored Pre-proline 0 CA--C 1.534 0.363 0 CA-C-O 118.721 -0.657 . . . . 0.0 109.997 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -72.57 155.43 54.76 Favored 'Trans proline' 0 N--CA 1.496 1.664 0 C-N-CA 121.383 1.389 . . . . 0.0 111.681 173.474 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.05 157.0 6.63 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 121.31 1.34 . . . . 0.0 111.613 178.268 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.3 tp -49.9 -29.94 9.18 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -177.048 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 56.8 t80 -55.15 -37.7 67.3 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.833 0.349 . . . . 0.0 111.207 -177.01 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B 1345 ' ' TRP . . . . . 0.575 ' CH2' HD13 ' A' ' 102' ' ' ILE . 20.3 t90 -61.11 -48.14 83.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.256 -177.059 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -62.02 -47.83 83.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.007 0.432 . . . . 0.0 110.531 -177.647 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -59.33 -44.59 92.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.838 -177.155 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -58.99 -46.59 87.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.699 -176.621 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.09 -47.88 84.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.721 -177.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.006 -176.725 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 87.0 p . . . . . 0 N--CA 1.458 -0.042 0 CA-C-O 120.937 0.398 . . . . 0.0 110.377 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mm -60.19 -45.2 96.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.215 -178.711 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.8 m -59.3 -44.45 92.52 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.525 -177.743 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -59.31 -45.99 89.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.542 -178.642 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.5 mtt -58.21 -44.18 88.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.126 0.489 . . . . 0.0 110.428 -178.101 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -60.09 -48.24 82.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.292 -178.455 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.664 ' HA ' HD12 ' A' ' 14' ' ' ILE . 9.8 tp -60.83 -32.35 71.74 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.193 -178.88 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.7 -50.2 72.09 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.668 0.27 . . . . 0.0 110.636 178.815 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.55 -41.91 86.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.031 0.443 . . . . 0.0 110.418 179.281 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.699 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 97.7 mt -54.17 -52.96 32.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.654 178.724 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -53.35 -23.42 9.37 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.435 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -59.53 -33.83 71.88 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -177.655 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.7 mm -108.5 -42.43 5.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.823 0.344 . . . . 0.0 110.173 -177.476 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -117.09 77.85 9.46 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.18 -177.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -55.04 -21.07 25.63 Favored 'Trans proline' 0 N--CA 1.498 1.753 0 C-N-CA 121.516 1.477 . . . . 0.0 113.529 -175.739 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.1 p90 -90.87 9.96 28.21 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.574 0.954 . . . . 0.0 113.574 -174.734 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.53 127.87 33.66 Favored 'General case' 0 C--O 1.231 0.123 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 175.372 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 69.1 tttt -97.46 -40.47 8.66 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.651 -176.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -157.93 155.81 30.18 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.679 -0.408 . . . . 0.0 111.38 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 37.0 mt -89.79 140.16 16.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.951 177.141 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.6 t -92.74 -47.13 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.83 176.727 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.496 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.0 t0 -156.49 158.97 38.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.884 178.466 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.5 p -143.24 134.58 26.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.162 0.506 . . . . 0.0 111.323 -179.429 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 24.1 t -109.58 124.69 51.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.598 176.45 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.0 t -54.36 -38.88 66.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.302 -172.013 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -149.11 125.85 11.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.205 0.526 . . . . 0.0 111.81 -178.057 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.454 HG21 ' HB3' ' A' ' 52' ' ' PHE . 87.3 t -145.18 139.28 22.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 114.986 -1.006 . . . . 0.0 109.506 -177.524 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.04 149.83 50.7 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.041 -178.601 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.607 ' CD2' HG21 ' A' ' 46' ' ' THR . 12.8 t80 -96.61 133.44 41.11 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.379 0.609 . . . . 0.0 111.884 -176.262 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -127.79 139.87 52.4 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.222 177.12 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 93.8 m -122.73 146.15 47.76 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.347 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -108.22 130.6 55.14 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.862 0.363 . . . . 0.0 110.317 176.258 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 29.9 t-20 -101.54 116.24 32.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.998 -0.547 . . . . 0.0 109.983 177.304 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.8 m -68.13 -33.05 73.77 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.902 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.0 p -62.23 -37.02 83.8 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.178 -177.483 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -95.56 -21.41 18.28 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -178.654 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 69.0 45.29 0.93 Allowed 'General case' 0 C--O 1.231 0.108 0 CA-C-O 121.424 0.631 . . . . 0.0 109.489 -177.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 32.0 tp10 -156.05 152.37 27.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.013 -177.221 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.45 ' CB ' HD12 ' B' 1338 ' ' LEU . 85.2 m95 -86.78 143.67 27.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.296 176.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.7 tp10 -125.0 129.42 50.29 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 176.14 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 20.4 pttp -75.11 138.86 42.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.127 177.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.607 HG21 ' CD2' ' A' ' 33' ' ' PHE . 68.5 p -92.4 167.57 11.89 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.16 -178.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -82.94 12.29 5.11 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 178.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.1 t -101.29 106.53 19.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-O 120.962 0.41 . . . . 0.0 110.289 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -130.7 113.87 14.69 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 176.675 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.67 176.57 38.97 Favored Glycine 0 CA--C 1.52 0.391 0 C-N-CA 120.221 -0.99 . . . . 0.0 112.322 -169.307 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.465 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -80.91 134.93 35.82 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 175.341 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.454 ' HB3' HG21 ' A' ' 31' ' ' VAL . 7.9 t80 -98.51 129.64 45.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.849 0.356 . . . . 0.0 110.201 -176.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.465 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.7 m-85 -132.96 143.53 49.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.237 177.516 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.668 HD11 HG23 ' A' ' 116' ' ' ILE . 69.0 mt -101.58 128.65 53.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 172.328 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.699 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 12.3 m-30 -108.58 135.78 49.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.843 0.354 . . . . 0.0 111.183 -175.473 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 50.1 t60 -118.34 143.26 46.75 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.238 176.685 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 60.0 ttt180 -141.97 147.92 37.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.147 178.727 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -86.83 28.07 0.93 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 178.873 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -159.1 167.36 29.4 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 -63.94 128.47 92.99 Favored Pre-proline 0 CA--C 1.538 0.509 0 CA-C-O 118.436 -0.793 . . . . 0.0 110.002 -178.11 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -74.94 140.93 70.08 Favored 'Cis proline' 0 N--CA 1.497 1.722 0 CA-C-N 121.943 1.729 . . . . 0.0 111.753 -1.051 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -65.45 -47.06 77.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.085 -177.217 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -142.69 137.37 29.83 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.431 0.634 . . . . 0.0 110.936 -176.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.0 t -151.14 152.28 33.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.45 -177.244 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.414 HG13 HD11 ' A' ' 80' ' ' ILE . 41.8 mt -107.04 141.61 21.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -131.74 141.93 49.65 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.371 -177.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.3 mt -128.38 131.42 69.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.25 0.548 . . . . 0.0 110.237 174.141 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -98.76 99.47 10.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 114.957 -1.019 . . . . 0.0 109.626 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -73.74 105.88 5.23 Favored 'General case' 0 N--CA 1.463 0.188 0 O-C-N 123.679 0.612 . . . . 0.0 110.717 -176.628 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 -73.64 -41.3 62.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.587 -170.462 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 66.5 mt -72.17 -45.21 61.36 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.551 -174.662 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 57.5 m-20 -95.07 -3.32 48.41 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.702 1.001 . . . . 0.0 113.702 -175.32 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.416 HG22 ' O ' ' A' ' 73' ' ' THR . 10.9 m 54.72 43.53 29.97 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 121.516 0.674 . . . . 0.0 110.748 176.696 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 32.6 m -126.99 145.21 50.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.511 -178.443 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 13.6 p -90.75 130.91 36.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.25 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -119.41 122.32 41.5 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 175.564 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 34.6 t -125.4 145.14 33.26 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-O 120.614 0.245 . . . . 0.0 110.623 -177.202 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -148.68 126.39 5.73 Favored Pre-proline 0 CA--C 1.538 0.501 0 CA-C-O 118.747 -0.644 . . . . 0.0 110.498 174.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -75.27 150.91 37.69 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 121.621 1.547 . . . . 0.0 111.891 175.848 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.414 HD11 HG13 ' A' ' 65' ' ' ILE . 66.4 mt -93.68 120.35 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.156 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.416 179.071 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 68.3 p -99.33 154.25 18.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.785 175.113 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -93.7 26.49 16.01 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.721 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.5 t -111.04 -12.86 14.16 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.411 0.522 . . . . 0.0 112.411 174.515 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 78.0 mt -67.52 146.14 54.23 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.072 0.463 . . . . 0.0 111.262 -176.098 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.1 tt0 -117.62 135.85 53.7 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.801 176.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 63.0 mt -112.18 155.56 23.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.923 0.392 . . . . 0.0 110.8 -177.488 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -147.55 144.16 28.31 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.079 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.0 t -99.48 109.09 21.68 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.668 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -106.77 103.78 48.5 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 171.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.18 143.52 44.31 Favored 'Trans proline' 0 N--CA 1.496 1.671 0 CA-C-N 120.527 1.224 . . . . 0.0 112.329 -169.607 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -90.4 14.93 48.91 Favored 'Cis proline' 0 N--CA 1.499 1.842 0 CA-C-N 121.05 1.411 . . . . 0.0 113.481 -4.443 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -95.46 170.67 9.2 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 122.419 0.288 . . . . 0.0 110.776 -177.582 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 52.4 tp -116.32 133.47 55.99 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 174.045 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.441 HD11 ' CG2' ' A' ' 102' ' ' ILE . 11.1 tp -125.09 140.51 52.82 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.392 -173.688 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 48.0 p90 -142.97 150.08 39.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.943 0.402 . . . . 0.0 110.523 175.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 26.5 mtm180 -102.37 146.9 27.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.26 -175.468 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -128.46 157.17 41.85 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.901 0.857 . . . . 0.0 111.367 -179.689 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 54.6 tt0 -49.57 150.05 2.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.724 -177.255 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 64.56 30.95 12.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.241 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 42.1 t 68.88 35.27 2.97 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.005 0.431 . . . . 0.0 111.645 164.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -98.96 140.61 32.85 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 177.531 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.441 ' CG2' HD11 ' A' ' 94' ' ' LEU . 78.9 mt -114.75 124.05 71.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -177.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -135.14 146.1 48.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.423 -178.409 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -144.33 169.35 26.4 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 120.888 -0.673 . . . . 0.0 111.648 -177.118 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -126.16 142.81 51.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.027 0.441 . . . . 0.0 110.752 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 73.7 t90 -106.31 125.01 50.47 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.443 174.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.437 ' CD1' HG22 ' A' ' 31' ' ' VAL . 64.5 m-85 -111.29 139.69 46.48 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 123.281 0.363 . . . . 0.0 110.611 -179.138 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -51.74 -37.53 51.46 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.678 179.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -132.54 136.06 46.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.42 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 84.5 p -62.8 -41.62 99.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.303 -177.507 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -59.85 -44.02 94.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.509 0.671 . . . . 0.0 110.016 178.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -56.51 -44.67 80.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.067 178.694 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 50.2 t -59.2 -39.72 83.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.519 177.802 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -58.89 -45.94 89.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.852 0.358 . . . . 0.0 110.642 -177.006 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 22.8 ttp-105 -61.33 -50.16 74.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.791 -177.142 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.668 HG23 HD11 ' A' ' 54' ' ' ILE . 30.2 mm -58.56 -44.16 88.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.051 0.453 . . . . 0.0 110.0 -178.19 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 59.7 p -59.85 -43.99 94.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.698 -177.655 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.56 -43.75 94.08 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 -178.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.496 HD13 ' HB2' ' A' ' 26' ' ' ASP . 12.0 mt -58.97 -48.5 81.31 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.05 0.453 . . . . 0.0 110.598 -178.382 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 54.5 t -59.07 -44.3 91.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.067 -178.495 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -57.39 -42.14 81.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.63 -178.559 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.9 -45.25 96.56 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -179.12 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 62.1 mt -58.65 -42.19 87.81 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.926 0.393 . . . . 0.0 110.642 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 88.0 mt . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.867 -178.988 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B 1338 ' ' LEU . . . . . 0.45 HD12 ' CB ' ' A' ' 43' ' ' TRP . 19.9 mt . . . . . 0 C--O 1.234 0.262 0 CA-C-O 118.493 -0.765 . . . . 0.0 109.613 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -79.15 139.63 15.13 Favored 'Trans proline' 0 N--CA 1.493 1.455 0 CA-C-N 120.394 1.176 . . . . 0.0 111.193 174.325 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 6.7 mtmp? -97.28 125.99 43.51 Favored Pre-proline 0 CA--C 1.535 0.403 0 CA-C-O 118.343 -0.837 . . . . 0.0 110.119 178.349 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -61.86 165.34 14.3 Favored 'Trans proline' 0 N--CA 1.497 1.722 0 CA-C-N 120.657 1.27 . . . . 0.0 111.655 177.133 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -49.27 156.98 2.2 Favored 'Trans proline' 0 N--CA 1.497 1.679 0 C-N-CA 121.395 1.397 . . . . 0.0 111.866 178.736 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B 1343 ' ' LEU . . . . . 0.515 ' H ' HD12 ' B' 1343 ' ' LEU . 6.2 mp -50.17 -29.19 8.74 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -176.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -56.4 -35.79 68.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.733 0.301 . . . . 0.0 111.429 -176.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 54.9 t90 -60.77 -48.14 83.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.955 0.407 . . . . 0.0 110.465 -176.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -65.23 -48.11 74.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.921 0.391 . . . . 0.0 110.804 -178.598 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -57.81 -44.39 86.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.964 0.412 . . . . 0.0 110.758 -176.535 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -59.19 -47.9 83.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.398 -177.312 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -57.82 -45.27 86.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.684 -177.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.319 -176.427 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.2 p . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.976 0.417 . . . . 0.0 110.427 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.2 mm -60.18 -44.44 95.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.198 -179.315 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.4 m -59.05 -44.71 91.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.991 0.424 . . . . 0.0 110.534 -177.834 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -59.36 -47.12 86.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.4 -178.472 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 87.2 mtp -58.29 -42.49 86.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.127 0.489 . . . . 0.0 110.41 -178.213 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -59.88 -48.5 81.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.298 -178.621 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.671 ' HA ' HD12 ' A' ' 14' ' ' ILE . 8.7 tp -60.4 -33.43 72.47 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.127 -178.68 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.5 -50.03 73.03 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.65 0.262 . . . . 0.0 110.688 179.041 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.11 -41.18 87.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.952 0.406 . . . . 0.0 110.565 179.173 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.703 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 96.8 mt -54.19 -52.88 33.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.618 178.507 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -53.61 -24.06 12.86 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -177.791 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.7 mtpt -60.25 -33.07 71.79 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -177.453 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 45.8 mm -109.12 -41.25 4.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.802 0.334 . . . . 0.0 110.407 -176.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -116.27 77.82 7.66 Favored Pre-proline 0 CA--C 1.535 0.392 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.311 -177.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -53.72 -20.46 17.06 Favored 'Trans proline' 0 N--CA 1.498 1.784 0 C-N-CA 121.469 1.446 . . . . 0.0 113.427 -176.881 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.2 p90 -94.42 17.63 12.66 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -174.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -92.45 127.5 37.96 Favored 'General case' 0 C--O 1.232 0.133 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 173.772 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.463 ' O ' HD21 ' A' ' 11' ' ' LEU . 79.2 tttt -101.57 -40.61 6.94 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.75 -176.338 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -150.59 156.37 41.25 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.976 0.417 . . . . 0.0 111.336 -179.463 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 58.1 mt -93.09 136.5 24.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.174 177.786 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.1 t -88.44 -47.1 15.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.753 176.91 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.495 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -152.34 157.01 40.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.865 177.883 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.4 p -143.29 131.98 22.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.988 0.423 . . . . 0.0 111.056 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.6 t -109.13 126.17 52.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.706 177.334 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.2 t -54.47 -39.08 67.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.243 -171.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -150.21 127.04 11.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.242 0.544 . . . . 0.0 111.722 -178.724 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.472 HG21 ' HB3' ' A' ' 52' ' ' PHE . 94.6 t -145.14 140.5 22.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.437 -177.622 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.46 149.81 51.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.14 -177.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -97.91 132.08 43.81 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.249 0.547 . . . . 0.0 111.588 -176.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -125.61 142.31 51.57 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.759 179.511 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 80.4 m -120.81 148.14 44.41 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.184 -0.672 . . . . 0.0 109.184 177.385 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -109.48 131.97 54.56 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.975 0.417 . . . . 0.0 110.483 176.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -104.25 116.15 31.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.969 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 85.1 p -69.85 -31.03 68.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.137 -176.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -61.9 -38.1 87.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.662 0.267 . . . . 0.0 110.914 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -95.49 -21.42 18.32 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -178.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 28.3 t30 69.16 43.67 1.07 Allowed 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.366 0.603 . . . . 0.0 109.739 -177.807 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -151.07 164.52 36.27 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.99 -177.364 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 85.0 m95 -96.01 141.55 29.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.468 178.313 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -123.88 127.46 48.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.945 177.024 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.9 ttpp -75.1 139.96 43.12 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 62.3 p -92.34 173.35 7.85 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.088 -179.228 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -84.83 12.6 7.07 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 178.647 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.7 t -104.28 106.48 20.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 121.0 0.428 . . . . 0.0 110.311 179.73 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -130.47 115.03 16.26 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 176.259 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.63 176.51 38.95 Favored Glycine 0 CA--C 1.52 0.367 0 C-N-CA 120.08 -1.057 . . . . 0.0 112.182 -169.534 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.454 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -81.36 136.51 35.74 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 175.474 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.472 ' HB3' HG21 ' A' ' 31' ' ' VAL . 8.9 t80 -99.15 129.91 45.43 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.085 -176.95 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.454 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 9.1 m-85 -133.46 143.13 48.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.287 177.759 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.678 HD11 HG23 ' A' ' 116' ' ' ILE . 69.9 mt -101.65 128.14 54.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 172.324 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.703 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 13.7 m-30 -108.42 134.39 51.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.836 0.351 . . . . 0.0 111.136 -174.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 59.6 t60 -119.68 140.09 51.2 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.19 176.428 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.3 tpt180 -142.15 149.84 40.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.709 177.056 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -86.85 28.12 0.93 Allowed 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.79 170.19 22.93 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -64.13 125.98 89.26 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-O 118.46 -0.781 . . . . 0.0 110.005 -178.223 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.65 140.93 65.37 Favored 'Cis proline' 0 N--CA 1.497 1.682 0 CA-C-N 121.844 1.694 . . . . 0.0 111.833 -1.296 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -65.7 -47.71 74.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.059 -177.369 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -142.15 135.38 28.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.458 0.647 . . . . 0.0 110.926 -176.537 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.0 t -150.93 152.36 33.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.413 -177.549 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.2 mt -107.93 140.13 27.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -131.73 142.0 49.67 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.625 -177.038 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.0 mt -127.89 130.9 70.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.238 0.542 . . . . 0.0 110.053 173.533 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -99.21 99.61 10.61 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.753 -179.442 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -71.69 105.07 3.56 Favored 'General case' 0 C--N 1.332 -0.183 0 O-C-N 123.757 0.661 . . . . 0.0 110.672 -177.295 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -72.52 -42.05 65.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.5 -170.415 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.8 mt -71.95 -45.27 61.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.702 -174.532 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 54.7 m-20 -95.02 -3.35 48.52 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -175.495 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.9 m 54.94 43.6 29.65 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.399 0.619 . . . . 0.0 110.648 177.183 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.7 m -125.35 141.59 51.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.531 -178.31 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 14.8 p -88.15 130.18 35.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.291 -179.256 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -118.85 122.29 42.0 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 175.038 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 30.3 t -125.5 145.75 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 120.678 0.275 . . . . 0.0 110.532 -177.133 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -149.14 126.36 5.52 Favored Pre-proline 0 CA--C 1.538 0.488 0 CA-C-O 118.698 -0.667 . . . . 0.0 110.561 174.093 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -75.41 150.95 37.12 Favored 'Trans proline' 0 N--CA 1.498 1.757 0 C-N-CA 121.463 1.442 . . . . 0.0 112.305 177.62 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 69.2 mt -92.65 133.93 32.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 CA-C-O 120.977 0.418 . . . . 0.0 110.249 178.122 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.0 p -132.14 158.48 41.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.775 177.413 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -94.68 35.03 4.4 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.026 -178.649 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.7 t -108.47 -23.31 11.92 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 173.633 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.5 mt -68.36 148.58 50.5 Favored 'General case' 0 C--O 1.23 0.077 0 CA-C-O 120.922 0.391 . . . . 0.0 111.324 -176.363 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.5 tt0 -118.16 135.84 53.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.784 176.51 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.4 mt -113.9 157.93 21.74 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.075 0.464 . . . . 0.0 111.0 -176.651 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -148.14 139.54 23.56 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.197 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.2 t -97.33 109.17 21.98 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.793 -179.025 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -106.71 103.74 48.16 Favored Pre-proline 0 C--N 1.329 -0.321 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 172.219 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -71.18 139.61 35.74 Favored 'Trans proline' 0 N--CA 1.496 1.676 0 CA-C-N 120.619 1.257 . . . . 0.0 112.002 -171.033 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -89.11 9.0 65.74 Favored 'Cis proline' 0 N--CA 1.501 1.943 0 CA-C-N 121.213 1.469 . . . . 0.0 113.764 -4.282 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -84.62 170.11 13.69 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.7 0.286 . . . . 0.0 111.223 -177.688 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 53.7 tp -118.66 131.75 56.17 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 170.701 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.449 HD11 ' CG2' ' A' ' 102' ' ' ILE . 11.6 tp -123.63 139.56 53.87 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 110.408 -0.219 . . . . 0.0 110.408 -174.891 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 11.7 p90 -144.49 151.3 38.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.938 0.399 . . . . 0.0 110.651 176.398 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.4 mtm180 -102.13 148.93 24.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.023 -176.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.2 m120 -130.91 165.65 22.63 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.841 0.829 . . . . 0.0 111.666 -178.451 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -48.39 148.17 2.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.092 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 71.9 mtt85 63.17 30.86 15.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.212 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 52.1 m 66.55 35.18 5.57 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.921 0.391 . . . . 0.0 111.598 166.108 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -98.16 149.45 22.52 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 178.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.616 HD13 ' CH2' ' B' 1345 ' ' TRP . 82.4 mt -117.89 127.84 75.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 121.064 0.459 . . . . 0.0 109.824 -177.78 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -135.99 150.38 49.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.382 177.803 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -142.25 169.36 25.43 Favored Glycine 0 CA--C 1.522 0.53 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 -176.8 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -125.38 139.45 53.66 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.847 0.356 . . . . 0.0 110.622 -179.448 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 7.4 t90 -107.75 127.55 53.78 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.57 175.243 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.451 ' CD2' HG22 ' A' ' 31' ' ' VAL . 71.4 m-85 -116.14 144.2 44.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.832 0.349 . . . . 0.0 110.682 -179.743 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -51.57 -37.49 49.98 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.626 178.461 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -134.06 135.92 43.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.846 0.355 . . . . 0.0 110.531 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.8 m -61.33 -42.01 97.98 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.098 -177.432 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -59.46 -43.5 93.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.401 0.62 . . . . 0.0 110.081 178.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -56.31 -44.84 80.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.084 178.637 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 42.9 t -59.94 -39.85 86.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.708 178.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -59.28 -45.31 91.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.771 0.319 . . . . 0.0 110.608 -177.066 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -60.08 -49.13 78.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.518 -177.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.678 HG23 HD11 ' A' ' 54' ' ' ILE . 35.3 mm -58.43 -45.49 89.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.047 0.451 . . . . 0.0 110.094 -178.392 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 68.3 p -59.72 -43.34 94.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.756 -177.523 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.74 -44.36 94.17 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 110.66 -0.976 . . . . 0.0 110.66 -179.014 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.495 HD13 ' HB2' ' A' ' 26' ' ' ASP . 10.8 mt -58.77 -48.29 81.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.081 0.467 . . . . 0.0 110.503 -178.403 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 52.0 t -58.91 -43.78 89.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.171 -178.623 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -57.46 -42.41 82.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.635 -178.66 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.32 -43.16 99.47 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 78.2 mt -61.79 -41.37 97.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.833 0.349 . . . . 0.0 111.044 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 27.6 mt . . . . . 0 C--N 1.327 -0.373 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.682 -177.263 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 10.8 mt . . . . . 0 C--O 1.233 0.218 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -79.14 139.73 15.2 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 C-N-CA 121.101 1.201 . . . . 0.0 111.241 175.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -97.3 125.96 43.59 Favored Pre-proline 0 CA--C 1.537 0.448 0 CA-C-O 118.474 -0.774 . . . . 0.0 109.915 178.653 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -78.17 169.05 20.91 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 121.272 1.315 . . . . 0.0 111.792 176.091 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -62.0 156.59 48.56 Favored 'Trans proline' 0 N--CA 1.495 1.616 0 C-N-CA 121.261 1.308 . . . . 0.0 111.41 177.641 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.9 tp -50.04 -28.55 7.22 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.451 0.538 . . . . 0.0 112.451 -176.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 67.9 t80 -54.84 -37.31 66.02 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.773 0.32 . . . . 0.0 111.304 -176.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B 1345 ' ' TRP . . . . . 0.616 ' CH2' HD13 ' A' ' 102' ' ' ILE . 46.1 t90 -61.61 -48.07 82.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.411 -176.617 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -61.88 -48.98 78.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.025 0.441 . . . . 0.0 110.41 -177.657 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -58.92 -45.13 91.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.879 -176.529 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -59.28 -47.03 86.89 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.651 -176.501 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.23 -47.21 86.95 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.779 -177.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.522 -173.873 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 85.8 p . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.988 0.423 . . . . 0.0 110.558 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.9 mm -60.43 -44.47 96.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.193 -178.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 35.2 m -59.41 -45.54 91.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.931 0.396 . . . . 0.0 110.499 -177.604 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -59.77 -45.42 92.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.553 -178.476 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 44.7 ttm -58.27 -43.04 87.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.049 0.452 . . . . 0.0 110.382 -178.34 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -60.5 -49.62 76.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.348 -178.199 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.75 ' HA ' HD12 ' A' ' 14' ' ' ILE . 13.7 tp -61.52 -30.67 70.78 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.412 -178.832 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.12 -50.12 71.75 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.621 0.248 . . . . 0.0 110.527 178.029 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.86 -41.05 86.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.976 0.417 . . . . 0.0 110.565 178.585 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.75 HD12 ' HA ' ' A' ' 11' ' ' LEU . 95.7 mt -54.21 -52.98 32.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.643 178.916 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 76.7 mttt -55.08 -26.8 40.32 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -177.059 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -61.98 -29.92 70.58 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 -177.238 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.7 mm -109.76 -40.49 4.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.699 0.285 . . . . 0.0 110.391 -176.206 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -115.37 83.23 10.28 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.241 -178.498 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -54.22 -21.39 22.39 Favored 'Trans proline' 0 N--CA 1.498 1.751 0 C-N-CA 121.444 1.429 . . . . 0.0 113.549 -175.562 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 34.7 p90 -97.29 20.52 11.38 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -175.041 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -102.89 130.87 50.07 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 173.321 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.487 ' O ' HD21 ' A' ' 11' ' ' LEU . 55.5 tttm -119.74 -35.19 3.57 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.625 0.25 . . . . 0.0 111.571 -175.644 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 85.4 tt0 -128.94 144.6 51.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.852 0.358 . . . . 0.0 110.585 -177.385 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.489 HG13 HD13 ' A' ' 11' ' ' LEU . 58.3 mt -99.04 131.02 47.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.803 173.959 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.3 t -90.42 -47.19 14.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.375 -0.375 . . . . 0.0 109.992 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.51 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -156.95 157.08 34.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.951 178.642 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.9 p -142.71 132.0 23.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.224 0.535 . . . . 0.0 111.293 -179.562 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.554 ' HG ' ' HD2' ' A' ' 107' ' ' PHE . 35.4 t -105.41 123.73 48.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.526 176.247 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 88.1 p -53.97 -37.16 63.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.455 -172.013 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -151.1 126.27 9.91 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.128 0.49 . . . . 0.0 111.449 -179.026 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.409 HG21 ' HB3' ' A' ' 52' ' ' PHE . 99.0 t -145.2 136.53 20.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.671 -177.548 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -127.47 149.85 49.92 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.966 -178.252 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -99.26 132.03 44.87 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-O 121.29 0.567 . . . . 0.0 111.931 -176.269 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -126.21 141.62 51.85 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.348 178.592 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.5 m -122.06 145.0 48.57 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 177.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -108.3 131.94 54.21 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.929 0.395 . . . . 0.0 110.451 176.808 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -102.99 114.34 28.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.858 176.547 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.4 m -67.86 -32.37 72.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.026 -177.231 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -62.32 -37.49 85.78 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.665 0.269 . . . . 0.0 111.129 -177.296 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -95.09 -21.48 18.52 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 32.0 t30 69.17 46.03 0.83 Allowed 'General case' 0 C--O 1.231 0.11 0 CA-C-O 121.505 0.669 . . . . 0.0 109.441 -177.709 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 72.7 tt0 -155.43 152.72 29.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.865 -177.406 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -89.34 143.76 26.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.387 177.703 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -124.35 128.53 49.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.832 176.118 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 26.4 pttm -75.45 140.16 42.71 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.031 178.262 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 52.5 p -92.3 170.21 9.97 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.111 -178.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -83.83 12.58 5.85 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 177.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.7 t -104.07 106.49 20.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.067 0.46 . . . . 0.0 110.281 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -132.38 115.79 16.03 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 176.084 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.41 38.97 Favored Glycine 0 CA--C 1.519 0.341 0 C-N-CA 120.153 -1.022 . . . . 0.0 112.5 -169.302 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.492 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -81.42 133.42 35.41 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 174.698 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.409 ' HB3' HG21 ' A' ' 31' ' ' VAL . 4.8 t80 -98.46 128.03 44.65 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -175.831 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.492 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.0 m-85 -132.43 142.66 49.35 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.353 177.48 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.626 HD11 HG23 ' A' ' 116' ' ' ILE . 69.6 mt -101.64 127.94 54.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 171.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.704 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 15.6 m-30 -108.47 135.55 49.56 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.812 0.339 . . . . 0.0 111.242 -176.299 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 37.1 t60 -114.9 143.26 45.42 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.935 173.947 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.5 tpt85 -142.1 148.94 39.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.456 . . . . 0.0 109.986 176.695 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -86.87 28.11 0.93 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.29 159.27 37.38 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.0 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -63.88 134.46 95.92 Favored Pre-proline 0 CA--C 1.537 0.475 0 CA-C-O 118.651 -0.69 . . . . 0.0 110.141 -175.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -67.43 140.81 54.57 Favored 'Cis proline' 0 N--CA 1.498 1.779 0 CA-C-N 121.603 1.608 . . . . 0.0 111.371 -3.025 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -68.54 -47.83 65.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.154 -177.037 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' HIS . . . . . 0.473 ' HB3' HD12 ' A' ' 80' ' ' ILE . 76.8 m80 -142.57 135.61 28.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.322 0.582 . . . . 0.0 110.84 -177.014 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 5.2 t -149.82 152.2 34.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.35 -176.722 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 56.4 mt -110.45 139.51 33.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.596 -179.43 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -131.75 142.12 49.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.723 -176.77 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.5 mt -123.15 127.1 74.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.144 0.497 . . . . 0.0 109.783 172.141 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -93.13 99.54 12.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.505 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -73.4 105.52 4.81 Favored 'General case' 0 C--N 1.332 -0.189 0 O-C-N 123.818 0.699 . . . . 0.0 110.881 -175.807 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 69.3 mtm180 -73.04 -42.43 63.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.602 -170.595 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.5 mt -72.94 -45.08 60.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.63 -174.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -94.97 -3.38 48.6 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -175.355 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 72.0 p 50.8 43.58 28.2 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.429 0.633 . . . . 0.0 111.238 177.2 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 35.5 m -128.27 131.35 48.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.408 -179.32 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 77.1 p -74.43 130.02 38.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.429 -179.224 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -117.03 122.2 43.52 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 173.154 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 39.6 t -125.56 146.8 30.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 120.852 0.358 . . . . 0.0 110.802 -177.387 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -149.51 126.45 5.41 Favored Pre-proline 0 CA--C 1.538 0.485 0 CA-C-O 118.723 -0.656 . . . . 0.0 110.354 174.359 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -75.3 150.96 37.62 Favored 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 121.443 1.429 . . . . 0.0 112.033 177.947 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.473 HD12 ' HB3' ' A' ' 63' ' ' HIS . 65.2 mt -87.12 131.95 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.138 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.586 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.7 p -132.16 157.98 42.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.599 176.725 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.543 ' HA2' HD22 ' A' ' 124' ' ' LEU . . . -108.83 38.91 3.1 Favored Glycine 0 CA--C 1.523 0.592 0 C-N-CA 121.115 -0.564 . . . . 0.0 111.856 -177.769 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 10.5 t -103.68 -30.07 10.67 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.767 -0.217 . . . . 0.0 111.156 172.001 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.23 149.0 44.97 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.828 0.347 . . . . 0.0 111.201 -176.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -106.52 141.71 37.37 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 175.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 66.9 mt -111.8 159.75 18.0 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.789 0.328 . . . . 0.0 110.504 -178.524 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -151.12 145.19 25.29 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 177.003 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 26.2 t -102.51 109.31 20.9 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.512 178.325 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -106.81 103.76 48.53 Favored Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 173.126 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -69.86 140.63 42.78 Favored 'Trans proline' 0 N--CA 1.497 1.7 0 CA-C-N 120.496 1.213 . . . . 0.0 112.074 -170.538 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -88.95 9.46 64.52 Favored 'Cis proline' 0 N--CA 1.5 1.905 0 CA-C-N 121.193 1.462 . . . . 0.0 113.697 -4.319 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -86.75 167.79 14.11 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.798 0.333 . . . . 0.0 111.109 -177.761 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 58.1 tp -115.75 133.97 55.49 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 170.688 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.474 HD21 ' HZ2' ' B' 1345 ' ' TRP . 12.4 tp -128.4 140.14 52.0 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.557 0.218 . . . . 0.0 110.469 -173.065 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 19.8 p90 -146.94 165.1 30.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.918 0.389 . . . . 0.0 110.592 176.641 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 37.8 mtt-85 -101.74 148.27 25.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.158 -178.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -128.83 163.94 24.12 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.867 0.841 . . . . 0.0 111.55 -177.54 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 32.0 mp0 -49.31 147.77 2.98 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.873 -176.798 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 79.6 mtm180 63.38 30.97 15.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.119 -0.946 . . . . 0.0 112.207 178.95 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 50.3 m 67.36 35.22 4.42 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.916 0.389 . . . . 0.0 111.535 167.092 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -101.49 152.71 20.44 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 179.333 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.519 HD13 ' CH2' ' B' 1345 ' ' TRP . 77.1 mt -111.07 129.6 66.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -179.178 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -137.96 149.39 46.1 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.897 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.96 168.85 26.37 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 111.274 -0.73 . . . . 0.0 111.274 -177.275 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -125.29 138.61 54.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.815 0.341 . . . . 0.0 110.602 -179.18 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 7.6 t90 -104.12 122.61 45.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.536 175.688 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.554 ' HD2' ' HG ' ' A' ' 28' ' ' SER . 35.9 m-85 -112.51 143.02 44.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.771 0.319 . . . . 0.0 110.554 -179.688 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 72.3 t80 -50.7 -35.87 33.29 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.702 178.38 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.9 t-20 -136.27 134.92 38.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.762 0.315 . . . . 0.0 110.462 179.219 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.6 t -61.68 -42.07 98.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.089 -177.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 -60.29 -43.54 96.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.375 0.607 . . . . 0.0 110.158 179.261 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 49.3 tt0 -56.62 -45.88 81.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.604 0.716 . . . . 0.0 110.0 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 38.4 t -60.56 -38.29 84.06 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.854 178.577 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -58.85 -46.22 88.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.923 0.392 . . . . 0.0 110.44 -177.748 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 51.2 mtp180 -58.98 -47.63 84.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.073 0.463 . . . . 0.0 110.552 -178.434 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.626 HG23 HD11 ' A' ' 54' ' ' ILE . 29.1 mm -58.23 -45.64 88.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.085 -179.03 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.0 p -59.29 -42.98 92.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.72 -177.103 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.6 -44.99 93.71 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.614 -0.995 . . . . 0.0 110.614 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.51 HD13 ' HB2' ' A' ' 26' ' ' ASP . 10.4 mt -58.67 -49.1 78.78 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.181 0.515 . . . . 0.0 110.491 -178.901 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.465 HG12 HD11 ' A' ' 124' ' ' LEU . 49.3 t -58.53 -41.42 81.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.265 -178.054 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.416 ' HA ' HD12 ' A' ' 124' ' ' LEU . 3.3 m-20 -58.5 -43.76 89.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.89 0.376 . . . . 0.0 110.593 -179.112 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -60.75 -40.78 98.58 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.262 -0.735 . . . . 0.0 111.262 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.9 mt -65.69 -43.06 90.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.645 0.26 . . . . 0.0 111.414 179.432 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.543 HD22 ' HA2' ' A' ' 82' ' ' GLY . 18.1 mt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.258 -176.388 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 8.3 mt . . . . . 0 CA--C 1.532 0.283 0 CA-C-O 118.55 -0.738 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -79.13 139.57 15.12 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 CA-C-N 120.211 1.111 . . . . 0.0 111.237 174.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -97.31 125.89 43.84 Favored Pre-proline 0 CA--C 1.536 0.436 0 CA-C-O 118.473 -0.775 . . . . 0.0 110.279 178.638 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -67.41 160.37 48.09 Favored 'Trans proline' 0 N--CA 1.497 1.712 0 C-N-CA 121.165 1.243 . . . . 0.0 111.627 175.33 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.82 156.86 2.94 Favored 'Trans proline' 0 N--CA 1.497 1.686 0 C-N-CA 121.288 1.326 . . . . 0.0 111.827 178.543 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.4 tp -50.04 -29.15 8.19 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -176.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 64.9 t80 -54.94 -38.27 67.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.932 0.396 . . . . 0.0 111.164 -177.27 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B 1345 ' ' TRP . . . . . 0.519 ' CH2' HD13 ' A' ' 102' ' ' ILE . 35.7 t90 -60.6 -48.2 82.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.206 -177.649 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -61.48 -48.18 82.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.965 0.412 . . . . 0.0 110.67 -176.737 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -60.0 -46.11 90.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.819 -176.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -58.08 -46.31 85.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.693 -175.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -61.56 -51.36 68.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.904 -176.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.343 -174.846 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 24.7 m . . . . . 0 CA--C 1.527 0.066 0 CA-C-O 120.823 0.344 . . . . 0.0 110.857 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.4 mm -59.52 -46.85 92.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.991 0.424 . . . . 0.0 110.041 -179.005 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.4 m -58.68 -44.38 90.21 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.15 0.5 . . . . 0.0 110.449 -178.339 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -59.2 -45.32 91.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.644 -178.571 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 89.6 mtp -58.29 -42.84 87.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.996 0.426 . . . . 0.0 110.463 -178.221 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -59.26 -49.44 77.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.027 0.441 . . . . 0.0 110.146 -178.925 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.707 ' HA ' HD12 ' A' ' 14' ' ' ILE . 14.1 tp -61.31 -30.36 70.45 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.36 -179.609 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.98 -49.91 72.85 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 122.224 -0.298 . . . . 0.0 110.579 177.862 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.94 -41.55 83.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.963 0.411 . . . . 0.0 110.464 178.422 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.72 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 92.6 mt -54.16 -53.03 32.1 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.748 179.23 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.6 mttp -53.8 -27.64 30.47 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -178.134 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -60.46 -32.2 71.18 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -176.503 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.513 HG21 ' CE2' ' A' ' 66' ' ' PHE . 47.3 mm -107.4 -41.08 5.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.864 0.364 . . . . 0.0 110.44 -176.031 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -115.13 83.36 9.83 Favored Pre-proline 0 CA--C 1.534 0.332 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.206 -178.691 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -53.65 -20.8 17.58 Favored 'Trans proline' 0 N--CA 1.498 1.759 0 C-N-CA 121.505 1.47 . . . . 0.0 113.422 -176.254 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -99.23 22.03 11.08 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.756 0.651 . . . . 0.0 112.756 -175.225 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -110.57 127.36 55.18 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 173.262 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.5 ' O ' HD21 ' A' ' 11' ' ' LEU . 16.7 pttp -122.99 -24.54 4.74 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -175.788 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.3 tp10 -127.77 140.26 52.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.726 0.298 . . . . 0.0 110.594 -179.768 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.486 HG13 HD13 ' A' ' 11' ' ' LEU . 52.6 mt -98.1 132.17 43.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.341 -0.39 . . . . 0.0 109.998 174.239 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.1 t -92.87 -47.13 13.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.173 179.938 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.499 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.9 t0 -155.02 156.31 35.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.038 178.69 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.4 p -143.03 131.98 22.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.098 0.475 . . . . 0.0 111.125 179.683 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.3 t -107.22 125.91 51.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.663 177.39 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 87.3 p -54.33 -37.77 65.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.309 -172.255 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -151.84 126.62 9.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.146 0.498 . . . . 0.0 111.688 -178.997 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.428 HG21 ' HB3' ' A' ' 52' ' ' PHE . 99.2 t -145.26 140.17 22.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.474 -177.713 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.15 149.88 50.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.147 -178.067 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.464 ' HD1' HG21 ' A' ' 46' ' ' THR . 32.3 t80 -97.89 133.62 42.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.187 0.518 . . . . 0.0 111.749 -176.383 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.406 ' CD2' HD11 ' B' 1338 ' ' LEU . 31.5 m-85 -126.56 142.0 51.68 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.467 178.973 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.606 HG23 ' CZ ' ' A' ' 103' ' ' ARG . 82.0 m -120.47 146.77 45.92 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.818 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -108.48 131.94 54.31 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.988 0.423 . . . . 0.0 110.471 176.125 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 -104.37 115.98 31.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.962 177.51 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 87.9 p -69.06 -31.46 70.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.064 -176.816 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.2 t -60.9 -39.84 90.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.763 0.316 . . . . 0.0 110.876 -177.58 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -94.43 -21.38 18.96 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -178.703 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.8 t30 69.79 43.62 0.93 Allowed 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.355 0.598 . . . . 0.0 109.748 -177.922 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -151.26 162.9 40.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.103 -177.77 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.457 ' CB ' HD12 ' B' 1338 ' ' LEU . 88.0 m95 -94.76 142.53 27.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.373 177.639 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -124.34 126.69 46.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 0.0 109.905 175.527 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 38.8 tttp -73.95 139.81 45.13 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.394 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.464 HG21 ' HD1' ' A' ' 33' ' ' PHE . 67.2 p -92.4 171.89 8.75 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.153 -178.365 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -83.75 12.49 5.88 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 178.681 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.5 t -102.43 106.47 19.94 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-O 120.964 0.411 . . . . 0.0 110.291 179.719 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -131.1 114.89 15.7 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 176.717 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.61 176.52 38.93 Favored Glycine 0 CA--C 1.519 0.295 0 C-N-CA 120.054 -1.069 . . . . 0.0 112.411 -169.67 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.489 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -81.26 134.7 35.64 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 175.145 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.428 ' HB3' HG21 ' A' ' 31' ' ' VAL . 5.4 t80 -98.3 127.57 44.3 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.079 -176.473 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.489 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.0 m-85 -131.84 142.27 49.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.276 177.654 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.689 HD11 HG23 ' A' ' 116' ' ' ILE . 68.5 mt -101.59 127.71 54.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 172.308 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.72 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.3 m-30 -108.47 136.86 47.38 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.838 0.352 . . . . 0.0 111.216 -175.922 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 68.2 t60 -114.68 141.64 47.55 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.34 175.295 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -142.31 146.93 35.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.835 176.459 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -86.77 28.09 0.92 Allowed 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.998 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.37 172.8 17.69 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.765 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -64.04 124.68 86.07 Favored Pre-proline 0 CA--C 1.539 0.535 0 CA-C-O 118.55 -0.738 . . . . 0.0 110.081 -178.129 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -79.11 140.98 60.46 Favored 'Cis proline' 0 N--CA 1.495 1.609 0 CA-C-N 121.79 1.675 . . . . 0.0 111.537 -1.677 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -63.73 -46.37 85.67 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.922 -177.613 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -142.37 136.22 29.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.274 0.559 . . . . 0.0 110.664 -177.46 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.3 t -150.26 151.33 32.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.454 -177.396 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.461 HG13 HD11 ' A' ' 80' ' ' ILE . 50.1 mt -110.86 139.51 34.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -179.228 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.513 ' CE2' HG21 ' A' ' 17' ' ' ILE . 62.9 t80 -131.83 142.06 49.61 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.81 -176.796 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 60.9 mt -123.82 127.31 73.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.214 0.531 . . . . 0.0 109.813 172.463 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 -94.25 99.54 11.76 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.011 -0.995 . . . . 0.0 109.445 -179.756 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.8 t-20 -74.48 105.75 5.76 Favored 'General case' 0 C--N 1.332 -0.165 0 O-C-N 123.728 0.642 . . . . 0.0 110.951 -175.474 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -71.84 -42.11 67.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.602 -170.879 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.8 mt -73.32 -45.17 56.88 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.781 -173.794 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 52.3 m-20 -95.07 -3.42 48.19 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -175.573 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.1 m 53.04 42.76 32.25 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.493 0.663 . . . . 0.0 111.039 177.095 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.1 m -128.49 132.68 48.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.585 -178.146 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 86.8 p -76.66 130.71 38.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.412 -179.296 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -118.0 122.26 42.74 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 172.965 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.427 HG22 ' HD2' ' A' ' 66' ' ' PHE . 31.4 t -125.55 146.39 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-O 120.745 0.307 . . . . 0.0 110.764 -176.399 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -147.88 126.37 6.09 Favored Pre-proline 0 CA--C 1.539 0.526 0 CA-C-O 118.633 -0.699 . . . . 0.0 110.43 173.836 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -75.47 150.91 36.83 Favored 'Trans proline' 0 N--CA 1.499 1.83 0 C-N-CA 121.453 1.435 . . . . 0.0 112.282 177.682 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.461 HD11 HG13 ' A' ' 65' ' ' ILE . 68.3 mt -93.21 134.64 30.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.229 177.715 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.1 p -132.14 158.06 42.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.702 177.401 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -94.27 34.96 4.4 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.059 -178.567 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.0 t -111.09 -21.15 12.1 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 173.79 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.9 mt -68.61 149.04 49.63 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-O 120.925 0.393 . . . . 0.0 111.379 -176.149 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -115.34 135.87 53.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.682 176.265 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 70.5 mt -114.81 155.21 27.19 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.913 0.387 . . . . 0.0 110.823 -176.963 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -148.7 142.77 25.93 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 178.317 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.6 t -103.52 109.19 20.75 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.645 -0.422 . . . . 0.0 110.919 -179.849 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -106.8 103.81 48.71 Favored Pre-proline 0 C--N 1.329 -0.318 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 171.333 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.09 141.91 49.36 Favored 'Trans proline' 0 N--CA 1.496 1.666 0 CA-C-N 120.477 1.206 . . . . 0.0 111.964 -172.126 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -89.86 11.66 58.31 Favored 'Cis proline' 0 N--CA 1.5 1.853 0 CA-C-N 121.108 1.431 . . . . 0.0 113.629 -3.613 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -90.41 168.25 12.01 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-O 120.62 0.248 . . . . 0.0 110.901 -178.365 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 54.6 tp -118.39 135.02 54.58 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 171.52 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.462 HD11 ' CG2' ' A' ' 102' ' ' ILE . 9.5 tp -126.97 139.15 53.26 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.539 0.209 . . . . 0.0 110.563 -174.487 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -143.13 148.63 36.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.986 0.422 . . . . 0.0 110.178 175.543 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 25.9 mtm180 -103.44 150.56 23.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.135 -175.854 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 -129.98 162.69 28.09 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.812 0.815 . . . . 0.0 111.221 -179.769 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 51.6 tt0 -49.51 149.55 2.27 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.72 -177.014 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 64.76 30.88 12.17 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.351 -0.841 . . . . 0.0 112.116 -179.834 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 18.2 m 66.64 35.11 5.45 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.958 0.409 . . . . 0.0 111.605 165.652 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 46.9 mtp85 -98.99 143.29 29.45 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.988 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.623 HD13 ' CH2' ' B' 1345 ' ' TRP . 75.9 mt -117.68 126.1 74.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-O 121.181 0.515 . . . . 0.0 110.055 -175.412 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 103' ' ' ARG . . . . . 0.606 ' CZ ' HG23 ' A' ' 35' ' ' THR . 81.4 mmt-85 -130.95 147.35 52.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.444 178.788 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -139.66 166.42 25.6 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 -178.143 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -125.33 139.8 53.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.878 0.371 . . . . 0.0 110.516 -179.741 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 15.5 t90 -107.49 124.81 50.44 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.464 174.314 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.407 ' CD2' HG22 ' A' ' 31' ' ' VAL . 55.8 m-85 -113.84 143.34 44.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.785 0.326 . . . . 0.0 110.667 -179.481 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -51.24 -35.96 39.47 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.618 178.232 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.5 t-20 -136.04 134.4 38.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.371 179.39 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.0 t -60.79 -41.42 95.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.012 -177.654 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -59.82 -43.21 94.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.315 0.578 . . . . 0.0 110.194 178.881 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -56.78 -45.32 82.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.511 0.672 . . . . 0.0 109.966 179.05 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 42.2 t -59.94 -39.04 84.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.711 178.351 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -59.31 -45.98 89.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.914 0.388 . . . . 0.0 110.577 -177.303 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 60.4 ttm-85 -59.36 -48.45 81.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.998 0.428 . . . . 0.0 110.523 -177.923 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 116' ' ' ILE . . . . . 0.689 HG23 HD11 ' A' ' 54' ' ' ILE . 30.8 mm -58.23 -45.97 88.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.058 -178.709 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 60.3 p -59.28 -43.07 92.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.665 -177.37 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.79 -44.37 94.25 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.654 -0.978 . . . . 0.0 110.654 -178.879 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.499 HD13 ' HB2' ' A' ' 26' ' ' ASP . 10.8 mt -58.4 -49.39 77.43 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.162 0.506 . . . . 0.0 110.528 -178.428 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 52.6 t -59.12 -42.63 87.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.13 -178.597 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 121' ' ' ASN . . . . . 0.405 ' HA ' HD12 ' A' ' 124' ' ' LEU . 87.4 m-20 -57.68 -41.96 82.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.795 0.331 . . . . 0.0 110.594 -178.95 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -60.84 -45.79 95.8 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.954 -0.859 . . . . 0.0 110.954 -179.806 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 58.6 mt -58.68 -42.28 88.17 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.901 0.381 . . . . 0.0 110.548 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.405 HD12 ' HA ' ' A' ' 121' ' ' ASN . 59.1 mt . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.796 -179.38 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B 1338 ' ' LEU . . . . . 0.457 HD12 ' CB ' ' A' ' 43' ' ' TRP . 13.1 mt . . . . . 0 C--O 1.233 0.235 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -79.01 139.75 15.44 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 121.172 1.248 . . . . 0.0 111.343 174.986 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -97.08 125.97 44.01 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-O 118.451 -0.785 . . . . 0.0 109.886 179.901 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -78.13 161.88 29.11 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 121.258 1.305 . . . . 0.0 111.868 176.177 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -50.86 150.01 13.54 Favored 'Trans proline' 0 N--CA 1.494 1.524 0 C-N-CA 121.293 1.329 . . . . 0.0 111.642 177.811 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 81.0 mt -49.91 -28.36 6.56 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -176.611 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 68.3 t80 -55.37 -38.39 68.76 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.859 0.361 . . . . 0.0 111.173 -176.923 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B 1345 ' ' TRP . . . . . 0.623 ' CH2' HD13 ' A' ' 102' ' ' ILE . 9.2 t90 -60.6 -48.06 83.46 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.301 -176.57 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -64.0 -48.5 76.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.898 0.38 . . . . 0.0 110.863 -176.983 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.36 -45.47 91.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.87 -176.326 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -59.75 -47.33 86.1 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.612 -176.424 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.12 -46.93 87.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.032 0.444 . . . . 0.0 110.753 -177.436 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.286 -176.284 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.326 0 N-CA-C 109.557 -1.417 . . . . 15.46 109.557 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -49.17 143.84 18.06 Favored 'Trans proline' 0 N--CA 1.495 1.593 0 C-N-CA 121.374 1.383 . . . . 14.57 112.041 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -137.4 138.95 40.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.11 -0.496 . . . . 17.96 110.589 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 64.8 mtt -102.89 142.87 33.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 13.7 110.553 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -68.04 150.48 48.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 10.3 110.589 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -71.73 127.48 32.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 7.47 110.559 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 0' ' ' LEU . . . . . 0.515 HD12 ' N ' ' A' ' 0' ' ' LEU . 6.4 mp -69.61 -37.92 77.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.193 -0.458 . . . . 8.19 111.097 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.3 mtt -78.33 138.9 38.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.814 0.34 . . . . 5.58 110.774 -178.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -103.3 152.64 21.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.129 -0.487 . . . . 2.98 110.524 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.94 141.32 55.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.141 -0.481 . . . . 2.25 110.717 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -62.67 -33.44 75.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 2.69 111.593 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 90.7 p -56.32 -40.05 73.76 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.898 0.38 . . . . 1.49 110.725 -178.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.4 mm -60.07 -46.3 94.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.279 -0.419 . . . . 0.54 110.182 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 36.2 m -58.85 -44.91 91.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.3 -0.409 . . . . 0.44 110.369 -177.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -59.22 -45.24 91.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.096 -0.502 . . . . 3.48 110.594 -178.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 96.9 mmm -58.2 -43.37 87.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.034 0.445 . . . . 1.56 110.417 -178.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.9 m120 -60.03 -49.46 77.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.156 -0.475 . . . . 1.04 110.202 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.747 ' HA ' HD12 ' A' ' 14' ' ' ILE . 14.4 tp -61.49 -30.07 70.38 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.593 -0.443 . . . . 0.26 111.368 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.05 -50.45 70.6 Favored 'General case' 0 C--N 1.333 -0.142 0 O-C-N 122.281 -0.262 . . . . 0.26 110.551 177.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.94 -42.01 84.01 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.078 0.466 . . . . 0.2 110.373 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.747 HD12 ' HA ' ' A' ' 11' ' ' LEU . 97.6 mt -54.05 -53.08 30.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.692 -0.685 . . . . 0.2 110.66 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 54.2 mttm -53.1 -26.46 16.51 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.551 0.574 . . . . 1.46 112.551 -178.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -59.49 -33.18 71.01 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 111.904 0.335 . . . . 3.34 111.904 -177.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 48.8 mm -104.48 -44.3 8.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.047 0.451 . . . . 0.32 110.089 -177.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -114.7 85.43 11.42 Favored Pre-proline 0 CA--C 1.534 0.338 0 CA-C-N 115.707 -0.679 . . . . 0.32 110.236 -176.433 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.07 -21.68 13.1 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 C-N-CA 121.399 1.399 . . . . 0.59 113.42 -176.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.0 p90 -100.01 17.2 21.62 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.347 0.869 . . . . 1.35 113.347 -174.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.408 ' HB3' HG22 ' A' ' 14' ' ' ILE . . . -94.31 118.97 32.38 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 109.09 -0.707 . . . . 0.35 109.09 173.122 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.488 ' O ' HD21 ' A' ' 11' ' ' LEU . 76.4 tttt -108.8 -37.78 5.79 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 120.835 -0.346 . . . . 2.95 111.513 -172.084 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -128.33 147.96 50.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.873 0.368 . . . . 1.78 110.979 -176.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.506 HG13 HD13 ' A' ' 11' ' ' LEU . 58.7 mt -102.98 131.77 50.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.009 -0.542 . . . . 0.25 109.926 173.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.8 t -92.1 -47.22 14.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.916 0.389 . . . . 0.16 110.031 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -155.9 156.17 34.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.028 -0.533 . . . . 0.13 110.059 178.088 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 59.7 p -142.5 132.0 23.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.936 0.398 . . . . 0.15 110.58 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.2 t -106.52 129.72 54.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.925 -0.579 . . . . 0.19 109.797 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 30.2 m -54.2 -38.7 65.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.715 -0.675 . . . . 1.31 111.251 -172.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -152.72 127.8 9.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.178 0.513 . . . . 0.3 111.598 -178.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.404 HG21 ' HB3' ' A' ' 52' ' ' PHE . 99.3 t -145.19 143.85 21.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.004 -0.998 . . . . 0.09 109.539 -177.797 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -131.15 149.82 52.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.562 -0.29 . . . . 0.13 111.094 -178.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -99.2 131.48 45.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.277 0.56 . . . . 1.47 111.507 -177.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -127.44 143.91 51.13 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 115.946 -0.57 . . . . 0.35 110.823 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 86.4 m -121.89 148.56 44.58 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.24 -0.652 . . . . 0.25 109.24 177.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -109.45 131.95 54.59 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.999 0.428 . . . . 1.11 110.441 176.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 -103.78 114.17 28.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.878 -0.601 . . . . 0.44 109.718 176.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 86.6 p -68.92 -30.3 68.73 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.903 -0.59 . . . . 1.36 112.196 -176.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.8 p -62.4 -39.17 92.37 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.686 0.279 . . . . 1.47 110.932 -177.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -94.5 -21.51 18.84 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.607 0.595 . . . . 2.0 112.607 -179.214 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 69.82 44.49 0.84 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 121.414 0.626 . . . . 1.3 109.652 -177.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -149.87 160.87 43.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.614 -0.721 . . . . 1.93 111.09 -177.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 80.7 m95 -94.66 140.76 29.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.085 -0.507 . . . . 0.3 110.379 177.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -122.87 129.08 51.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.274 -0.421 . . . . 2.3 110.039 177.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 72.9 tttt -76.84 140.39 40.63 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.948 -0.39 . . . . 2.6 109.948 178.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.1 p -92.34 176.0 6.64 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.723 -0.391 . . . . 0.32 110.131 -179.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -86.17 12.94 8.66 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.638 0.607 . . . . 2.17 112.638 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.8 t -106.94 106.42 20.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-O 120.916 0.389 . . . . 0.33 110.381 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -130.39 113.02 13.82 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.575 -0.898 . . . . 0.29 108.575 174.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.66 176.48 38.97 Favored Glycine 0 CA--C 1.52 0.376 0 C-N-CA 120.191 -1.004 . . . . 0.1 112.361 -168.651 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.461 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -79.37 136.15 36.91 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.9 -0.778 . . . . 0.09 108.9 174.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.404 ' HB3' HG21 ' A' ' 31' ' ' VAL . 4.9 t80 -101.94 127.23 48.87 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.96 -0.296 . . . . 0.1 110.388 -175.063 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.461 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 6.3 m-85 -130.61 142.19 50.45 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.785 0.326 . . . . 0.11 110.647 177.379 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.657 HD11 HG23 ' A' ' 116' ' ' ILE . 68.1 mt -101.55 127.1 55.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.241 -0.652 . . . . 0.16 109.241 171.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.688 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 13.8 m-30 -108.58 138.17 45.32 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.015 0.436 . . . . 0.21 111.285 -177.137 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 68.2 t60 -111.5 143.38 42.45 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.359 -0.837 . . . . 0.26 110.213 175.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -139.51 147.11 40.81 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.873 -0.603 . . . . 2.62 110.002 178.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -86.92 28.13 0.93 Allowed 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.15 -0.477 . . . . 1.26 112.136 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.52 160.79 38.57 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.735 -0.468 . . . . 0.36 109.735 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -63.98 131.16 94.87 Favored Pre-proline 0 CA--C 1.54 0.581 0 CA-C-O 118.483 -0.77 . . . . 2.53 110.059 -176.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -71.79 140.86 67.96 Favored 'Cis proline' 0 N--CA 1.498 1.752 0 CA-C-N 121.734 1.655 . . . . 0.63 111.58 -1.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -63.95 -40.43 96.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.278 -0.419 . . . . 1.34 111.079 -177.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.472 ' HB3' HD12 ' A' ' 80' ' ' ILE . 77.7 m80 -142.65 141.35 31.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.589 0.709 . . . . 0.3 111.044 -176.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.3 t -149.19 151.55 34.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.595 -0.729 . . . . 0.19 110.02 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.419 HG13 HD11 ' A' ' 80' ' ' ILE . 57.0 mt -115.62 138.98 44.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.43 . . . . 0.2 109.883 -177.024 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -131.85 142.14 49.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.787 -0.642 . . . . 1.27 111.1 -177.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.4 mt -120.33 128.99 76.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-O 121.235 0.54 . . . . 0.16 109.578 171.109 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -94.73 99.5 11.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.022 -0.99 . . . . 0.11 109.191 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.3 t-20 -72.53 105.84 4.36 Favored 'General case' 0 C--N 1.333 -0.138 0 O-C-N 123.65 0.594 . . . . 0.19 111.031 -174.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -73.87 -40.96 62.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.836 -0.62 . . . . 3.41 111.252 -171.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 70.9 mt -70.81 -45.23 64.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.359 -0.382 . . . . 0.29 111.644 -175.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 62.3 m-20 -95.06 -3.33 48.41 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 113.761 1.023 . . . . 1.89 113.761 -175.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.438 ' O ' HG22 ' A' ' 73' ' ' THR . 14.5 m 55.88 43.41 27.57 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-O 121.521 0.677 . . . . 1.18 110.49 177.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 34.5 m -127.45 148.87 50.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.441 -0.799 . . . . 0.39 110.618 -178.016 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.1 p -100.82 131.95 46.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.09 -0.505 . . . . 0.61 110.88 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -128.57 122.18 30.44 Favored 'General case' 0 N--CA 1.462 0.175 0 N-CA-C 110.204 -0.295 . . . . 1.38 110.204 175.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 p -125.57 149.95 30.59 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 116.358 -0.383 . . . . 1.25 111.004 -177.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -149.35 136.86 11.26 Favored Pre-proline 0 CA--C 1.538 0.488 0 CA-C-O 119.053 -0.499 . . . . 1.81 110.755 174.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.39 150.91 37.19 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 121.691 1.594 . . . . 0.28 112.378 178.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.472 HD12 ' HB3' ' A' ' 63' ' ' HIS . 64.4 mt -89.39 123.76 41.77 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 C-N-CA 120.657 -0.417 . . . . 0.25 110.47 178.452 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 40.4 p -99.35 159.02 15.31 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.073 -0.512 . . . . 0.55 110.065 175.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -98.41 7.75 61.94 Favored Glycine 0 CA--C 1.534 1.231 0 C-N-CA 120.97 -0.633 . . . . 0.5 113.597 -178.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.8 p -98.76 -5.31 31.56 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 117.947 0.873 . . . . 1.31 112.932 177.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.5 mt -68.99 141.18 54.98 Favored 'General case' 0 C--O 1.232 0.143 0 O-C-N 122.062 -0.398 . . . . 0.89 111.47 -177.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 57.2 tt0 -112.08 135.83 52.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.086 -0.507 . . . . 0.66 109.638 175.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.478 HD12 ' ND2' ' A' ' 121' ' ' ASN . 69.4 mt -113.84 158.38 21.1 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.03 0.443 . . . . 0.26 111.25 -175.26 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -148.71 145.68 27.78 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.814 -0.81 . . . . 0.66 108.814 176.055 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.1 t -114.63 109.3 18.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.009 0.433 . . . . 0.3 111.433 -177.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -106.82 103.54 47.61 Favored Pre-proline 0 CA--C 1.532 0.262 0 N-CA-C 108.672 -0.862 . . . . 1.29 108.672 169.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 91' ' ' PRO . 23.2 Cg_endo -62.08 141.86 90.29 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 CA-C-N 120.593 1.248 . . . . 0.51 111.457 -171.475 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 90' ' ' PRO . 89.4 Cg_endo -95.38 14.48 41.32 Favored 'Cis proline' 0 N--CA 1.497 1.724 0 CA-C-N 121.143 1.444 . . . . 0.45 113.649 -3.245 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -107.45 136.64 46.9 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 122.525 -0.11 . . . . 1.29 110.896 -175.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.464 HD22 ' OG ' ' A' ' 117' ' ' SER . 36.5 tp -92.93 136.58 33.12 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 120.503 -0.479 . . . . 0.23 110.63 -176.604 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.5 HD11 ' CG2' ' A' ' 102' ' ' ILE . 8.7 tp -124.02 139.64 53.75 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.068 -0.515 . . . . 0.26 110.324 -173.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.1 p90 -143.96 153.95 42.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.822 0.344 . . . . 1.23 110.586 176.194 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 27.0 mtm105 -101.98 146.82 27.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.103 -0.499 . . . . 1.56 110.606 -178.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 16.5 t30 -129.97 168.43 16.69 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.667 0.746 . . . . 1.66 111.552 -177.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -47.08 145.8 2.01 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.566 -0.743 . . . . 2.32 112.233 -176.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 60.3 mtp180 63.82 30.91 14.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.168 -0.924 . . . . 3.51 112.146 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.2 m 65.19 35.12 8.01 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.949 0.404 . . . . 1.3 111.524 167.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 36.2 mtp180 -98.28 151.98 19.91 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.307 -0.627 . . . . 2.68 109.307 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.669 HD13 ' CH2' ' B' 1345 ' ' TRP . 72.3 mt -117.12 127.52 74.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 121.153 0.502 . . . . 0.23 110.068 -176.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 81.0 mtt85 -138.41 150.33 46.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.66 -0.7 . . . . 1.75 109.495 178.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.7 168.77 26.26 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 120.787 -0.72 . . . . 0.2 111.81 -176.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -125.27 135.02 52.1 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.279 -0.46 . . . . 1.45 110.269 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 46.5 t90 -107.46 131.01 54.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.012 -0.54 . . . . 0.78 109.899 177.37 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -117.17 149.77 39.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.792 0.329 . . . . 1.18 110.602 -179.386 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -52.63 -37.71 58.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.137 -0.483 . . . . 1.21 111.441 176.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.5 t-20 -131.28 135.2 47.1 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.467 -0.333 . . . . 0.33 110.53 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.7 t -61.97 -41.99 98.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.271 -0.422 . . . . 1.38 111.084 -177.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -60.03 -43.68 95.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.432 0.634 . . . . 0.97 110.096 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -56.43 -44.59 80.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.635 -0.711 . . . . 0.14 109.996 178.309 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 38.0 t -59.83 -38.5 82.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.494 -0.775 . . . . 0.24 110.732 177.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -59.11 -46.32 88.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.917 0.389 . . . . 1.63 110.527 -177.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 -59.54 -49.17 78.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.141 0.496 . . . . 3.38 110.599 -177.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.657 HG23 HD11 ' A' ' 54' ' ' ILE . 27.5 mm -58.49 -46.51 89.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.42 0.629 . . . . 0.13 109.973 -178.393 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.464 ' OG ' HD22 ' A' ' 93' ' ' LEU . 20.9 m -58.65 -40.9 84.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.97 -0.559 . . . . 0.76 110.682 -177.734 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -56.9 -42.43 92.34 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 110.688 -0.965 . . . . 0.18 110.688 -179.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.545 HD12 ' HA ' ' A' ' 116' ' ' ILE . 16.0 mt -57.79 -50.05 74.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.438 0.637 . . . . 0.18 110.275 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 53.1 t -58.46 -43.62 87.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.546 -0.752 . . . . 0.23 110.109 -177.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.478 ' ND2' HD12 ' A' ' 86' ' ' LEU . 24.4 m120 -57.45 -41.51 80.65 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.3 -0.409 . . . . 1.04 110.634 -178.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.43 -45.63 95.5 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 111.184 -0.766 . . . . 0.29 111.184 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 66.8 mt -57.89 -41.7 83.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.899 0.38 . . . . 0.33 110.621 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 88.5 mt -59.64 -40.57 88.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.007 -0.542 . . . . 0.55 110.749 -179.296 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 16.7 pttp -93.95 -3.32 51.77 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 113.392 0.886 . . . . 1.36 113.392 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 24.4 t -131.09 135.22 47.33 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 118.127 0.421 . . . . 1.56 110.622 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 56.3 tttp . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 117.989 -1.005 . . . . 3.52 110.628 -179.969 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.346 0 N-CA-C 109.53 -1.428 . . . . 25.24 109.53 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -49.57 140.91 27.6 Favored 'Trans proline' 0 N--CA 1.496 1.629 0 C-N-CA 121.31 1.34 . . . . 24.41 112.005 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 57.7 tp60 -100.16 125.56 46.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.244 -0.434 . . . . 21.25 110.506 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -67.86 153.41 95.24 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.278 -0.419 . . . . 19.71 110.532 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -78.82 140.31 16.22 Favored 'Trans proline' 0 N--CA 1.493 1.493 0 C-N-CA 121.396 1.397 . . . . 18.02 112.038 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1323 ' ' LEU . . . . . 0.517 ' H ' HD12 ' B' 1323 ' ' LEU . 6.4 mp -63.08 -41.49 99.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.176 -0.465 . . . . 17.84 110.607 179.64 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.5 mt -108.96 136.71 48.05 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.245 -0.434 . . . . 15.4 110.391 179.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -124.48 134.19 53.12 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.325 -0.398 . . . . 13.63 110.547 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -89.8 -58.49 2.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.18 -0.464 . . . . 17.12 110.361 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -129.23 156.51 43.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.118 -0.492 . . . . 13.41 110.263 179.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -72.92 111.87 8.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 9.79 110.511 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.65 155.95 39.67 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.464 . . . . 7.76 110.567 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -74.65 140.72 26.85 Favored 'Trans proline' 0 N--CA 1.494 1.521 0 C-N-CA 121.301 1.334 . . . . 6.7 111.945 178.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 12.1 t80 -133.83 99.88 13.68 Favored Pre-proline 0 CA--C 1.534 0.335 0 CA-C-O 119.076 -0.487 . . . . 5.8 110.392 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -59.34 128.91 29.09 Favored 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 121.066 1.177 . . . . 3.82 111.586 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 100.25 -5.17 57.37 Favored Glycine 0 CA--C 1.534 1.267 0 CA-C-N 116.026 -0.534 . . . . 2.87 113.466 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -88.49 120.72 30.13 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 118.204 1.002 . . . . 3.0 110.459 178.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 7.2 ttt -78.39 140.42 60.43 Favored Pre-proline 0 CA--C 1.533 0.32 0 CA-C-O 118.947 -0.549 . . . . 1.11 110.004 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -71.66 151.51 58.19 Favored 'Trans proline' 0 N--CA 1.496 1.656 0 C-N-CA 121.232 1.288 . . . . 1.01 111.639 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 25.8 m120 -101.16 110.43 22.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.841 0.353 . . . . 2.57 110.746 -178.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 8.4 mt -69.91 151.23 96.29 Favored Pre-proline 0 C--N 1.33 -0.262 0 N-CA-C 109.59 -0.522 . . . . 0.51 109.59 177.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -79.06 139.79 15.37 Favored 'Trans proline' 0 N--CA 1.492 1.386 0 C-N-CA 121.057 1.171 . . . . 0.6 111.08 174.397 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -97.17 125.78 44.54 Favored Pre-proline 0 CA--C 1.535 0.391 0 CA-C-O 118.512 -0.756 . . . . 2.42 109.955 179.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -78.18 169.04 20.9 Favored 'Trans proline' 0 N--CA 1.497 1.721 0 C-N-CA 121.311 1.34 . . . . 0.7 112.015 176.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -65.18 157.08 59.46 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 121.328 1.352 . . . . 0.67 111.396 176.357 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 9.8 tt -50.0 -32.82 16.14 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.131 0.419 . . . . 1.84 112.131 -176.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 58.4 t80 -54.28 -36.16 63.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.85 0.357 . . . . 3.35 111.418 -176.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1345 ' ' TRP . . . . . 0.669 ' CH2' HD13 ' A' ' 102' ' ' ILE . 12.1 t90 -61.75 -48.18 81.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.37 -0.377 . . . . 0.37 110.448 -176.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -62.45 -47.93 81.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.042 0.449 . . . . 1.82 110.574 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -59.45 -44.49 92.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.142 -0.481 . . . . 2.4 110.905 -177.31 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -59.03 -46.39 88.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.249 -0.432 . . . . 1.53 110.654 -176.608 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.53 -48.0 83.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.113 0.482 . . . . 0.43 110.631 -177.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.11 -42.23 90.04 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.974 -0.557 . . . . 2.09 111.141 -176.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -64.42 -47.97 77.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 3.34 111.05 -177.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -55.01 -45.91 75.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.303 -0.408 . . . . 2.23 111.17 -178.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 43.0 tp10 -65.0 -36.99 86.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.374 -0.375 . . . . 1.84 111.054 178.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -76.26 147.97 37.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.801 0.334 . . . . 1.64 110.526 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 13.1 tp . . . . . 0 C--O 1.221 -0.421 0 CA-C-O 118.007 -0.997 . . . . 3.76 110.497 179.943 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.72 -31.38 49.16 Favored 'Trans proline' 0 N--CA 1.496 1.619 0 C-N-CA 121.319 1.346 . . . . 0.0 112.212 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 75.5 m80 -131.3 162.8 29.23 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.487 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 86.0 mtp -115.17 162.97 16.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.457 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -57.84 141.5 48.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.556 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -84.14 120.56 26.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.442 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 29.4 tp -56.53 -39.97 74.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.896 -179.159 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.0 mmm -93.79 127.73 39.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.481 -179.665 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.72 149.52 21.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.565 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -97.36 105.96 18.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.559 179.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -66.76 -35.74 80.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.321 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.6 p -56.87 -40.69 76.63 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.89 0.376 . . . . 0.0 110.721 -177.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mm -60.39 -47.18 93.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.0 0.429 . . . . 0.0 110.211 -178.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.6 m -58.94 -43.88 91.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.565 -177.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.0 mtp85 -59.75 -44.95 93.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.626 -178.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 97.2 mmm -58.24 -43.92 88.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.005 0.431 . . . . 0.0 110.425 -178.111 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -60.7 -49.69 76.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.271 -178.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.657 ' HA ' HD12 ' A' ' 14' ' ' ILE . 10.6 tp -59.33 -32.9 70.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.05 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.69 -50.68 68.26 Favored 'General case' 0 C--N 1.332 -0.166 0 O-C-N 122.294 -0.254 . . . . 0.0 110.906 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.75 -41.71 82.45 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.99 0.424 . . . . 0.0 110.502 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.657 HD12 ' HA ' ' A' ' 11' ' ' LEU . 94.9 mt -54.18 -53.07 31.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.715 177.782 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -52.88 -21.34 4.16 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -57.91 -35.4 71.01 Favored 'General case' 0 C--N 1.332 -0.169 0 O-C-N 122.33 -0.231 . . . . 0.0 111.477 -177.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.656 HG21 ' HB2' ' A' ' 75' ' ' SER . 45.8 mm -113.01 -39.78 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-O 120.776 0.322 . . . . 0.0 110.554 -177.202 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -117.29 77.2 9.65 Favored Pre-proline 0 CA--C 1.535 0.367 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.162 -178.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -55.69 -21.49 32.13 Favored 'Trans proline' 0 N--CA 1.498 1.738 0 C-N-CA 121.512 1.475 . . . . 0.0 113.396 -175.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -88.69 8.76 27.04 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -174.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -86.81 124.77 33.42 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 174.263 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.594 ' O ' HD21 ' A' ' 11' ' ' LEU . 67.7 mttm -105.61 -39.35 6.12 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.798 0.332 . . . . 0.0 111.173 -174.025 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -134.72 144.78 47.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.97 0.414 . . . . 0.0 111.064 -176.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.405 HD11 HD12 ' A' ' 14' ' ' ILE . 24.4 mt -96.34 131.32 43.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 172.59 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.1 t -91.49 -47.19 14.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 0.0 109.929 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.492 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -153.03 152.01 30.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.844 178.486 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.9 p -139.86 131.94 27.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.083 0.468 . . . . 0.0 110.958 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 45.0 t -105.37 126.9 52.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.654 176.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.1 m -54.4 -38.9 66.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.191 -172.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -151.31 127.04 10.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.217 0.532 . . . . 0.0 111.501 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.464 HG22 ' CD2' ' A' ' 107' ' ' PHE . 96.5 t -144.91 142.31 22.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.526 -177.613 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -131.53 149.87 52.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.203 -178.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.438 ' HD2' HG21 ' A' ' 46' ' ' THR . 20.5 t80 -100.68 131.33 46.64 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.656 -176.555 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -127.16 144.45 51.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.819 178.011 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 74.7 m -122.46 149.48 43.81 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.574 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -109.48 131.93 54.61 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.854 0.359 . . . . 0.0 110.316 175.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.0 t-20 -103.92 114.7 29.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.73 176.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 84.8 p -68.6 -31.41 70.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.058 -177.001 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.2 m -61.91 -38.61 89.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.686 0.279 . . . . 0.0 110.964 -177.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -95.1 -21.44 18.54 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -178.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 51.0 t30 68.95 45.65 0.92 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-O 121.411 0.624 . . . . 0.0 109.343 -177.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 76.8 tt0 -151.49 150.58 30.54 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.281 -176.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 78.2 m95 -85.32 138.46 32.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.871 175.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -122.05 126.39 48.37 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 177.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -73.8 139.71 45.35 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 177.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.438 HG21 ' HD2' ' A' ' 33' ' ' PHE . 69.7 p -92.31 175.42 6.85 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.181 -178.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.6 p30 -86.51 13.71 7.98 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.1 t -108.5 106.42 20.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 121.047 0.451 . . . . 0.0 110.342 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -131.49 112.1 12.36 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 174.215 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.64 176.56 38.95 Favored Glycine 0 CA--C 1.522 0.48 0 C-N-CA 120.125 -1.036 . . . . 0.0 112.283 -168.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.491 ' HB2' HH21 ' A' ' 70' ' ' ARG . . . -77.47 135.85 38.3 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 174.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -103.04 126.96 50.45 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.368 -175.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.475 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 5.0 m-85 -130.04 142.07 50.66 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.744 0.307 . . . . 0.0 110.72 177.105 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.59 HD11 HG23 ' A' ' 116' ' ' ILE . 68.3 mt -101.59 126.9 55.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 171.044 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.62 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 14.2 m-30 -108.65 138.56 44.77 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.995 0.426 . . . . 0.0 111.552 -177.133 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -108.82 143.34 38.13 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.976 173.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -140.49 146.34 38.05 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.111 178.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -86.88 28.11 0.93 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 112.1 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.97 162.77 38.22 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -63.91 129.88 94.13 Favored Pre-proline 0 CA--C 1.539 0.528 0 CA-C-O 118.448 -0.787 . . . . 0.0 110.002 -177.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -73.46 140.93 70.01 Favored 'Cis proline' 0 N--CA 1.498 1.793 0 CA-C-N 121.867 1.703 . . . . 0.0 111.681 -1.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -63.09 -40.73 98.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.925 -177.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.475 ' HB3' HD12 ' A' ' 80' ' ' ILE . 77.9 m80 -143.02 140.51 31.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.401 0.619 . . . . 0.0 110.944 -177.151 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.5 t -149.81 152.31 34.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.281 -178.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.428 HG13 HD11 ' A' ' 80' ' ' ILE . 53.1 mt -116.13 138.65 45.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 -177.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -131.87 142.09 49.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.135 -176.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.6 mt -121.05 131.47 72.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.186 0.517 . . . . 0.0 109.833 172.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -98.71 99.56 10.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.902 -1.044 . . . . 0.0 109.335 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.4 t-20 -73.2 107.71 5.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.271 0.558 . . . . 0.0 111.268 -174.376 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.491 HH21 ' HB2' ' A' ' 51' ' ' ALA . 96.8 mtt180 -73.47 -39.38 64.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.272 -172.312 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 70.2 mt -73.23 -45.19 57.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.719 -174.347 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -95.05 -3.42 48.27 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.753 1.019 . . . . 0.0 113.753 -175.506 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.8 m 55.95 43.14 27.82 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 121.477 0.656 . . . . 0.0 110.49 177.551 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.8 m -130.13 149.02 52.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.332 -178.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.656 ' HB2' HG21 ' A' ' 17' ' ' ILE . 4.0 p -102.66 139.98 37.54 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.094 -179.126 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -134.64 122.25 22.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.185 177.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.7 p -125.55 148.49 30.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.038 -177.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 55.5 tt0 -148.66 137.07 11.62 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-O 119.063 -0.494 . . . . 0.0 110.622 175.149 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.53 150.95 36.63 Favored 'Trans proline' 0 N--CA 1.498 1.744 0 C-N-CA 121.67 1.58 . . . . 0.0 112.268 178.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.475 HD12 ' HB3' ' A' ' 63' ' ' HIS . 63.4 mt -89.42 121.07 39.15 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 C-N-CA 120.711 -0.395 . . . . 0.0 110.363 178.037 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 71.0 p -99.1 160.8 14.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.052 176.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -97.38 7.31 63.83 Favored Glycine 0 CA--C 1.533 1.215 0 C-N-CA 120.877 -0.678 . . . . 0.0 113.607 -178.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.7 p -99.04 -3.75 34.04 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 117.927 0.863 . . . . 0.0 113.015 177.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.0 mt -68.36 144.45 54.77 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 118.1 0.409 . . . . 0.0 111.166 -177.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.1 tt0 -115.97 135.84 53.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.78 176.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.403 HD12 ' OD1' ' A' ' 121' ' ' ASN . 60.0 mt -117.23 157.74 25.51 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.896 0.379 . . . . 0.0 110.854 -176.15 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -150.14 143.36 25.0 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.0 t -98.59 109.11 21.92 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.491 178.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.4 ' HG3' HD22 ' A' ' 94' ' ' LEU . 20.9 mm-40 -106.87 103.75 48.64 Favored Pre-proline 0 C--N 1.328 -0.329 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 172.273 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -70.4 143.11 46.82 Favored 'Trans proline' 0 N--CA 1.497 1.702 0 CA-C-N 120.541 1.229 . . . . 0.0 112.027 -171.292 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -90.94 14.59 50.13 Favored 'Cis proline' 0 N--CA 1.5 1.858 0 CA-C-N 121.041 1.407 . . . . 0.0 113.481 -3.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -95.97 172.28 8.1 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.531 0.205 . . . . 0.0 110.627 -177.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.8 tp -113.98 135.01 54.46 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 172.35 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.402 HD21 ' HZ2' ' B' 1345 ' ' TRP . 9.0 tp -126.02 139.19 53.62 Favored 'General case' 0 C--N 1.333 -0.114 0 N-CA-C 110.428 -0.212 . . . . 0.0 110.428 -173.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 50.8 p90 -145.97 154.43 41.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.965 0.412 . . . . 0.0 110.627 174.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.6 mtm180 -104.75 149.13 25.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.729 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -129.96 165.56 21.87 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.856 0.836 . . . . 0.0 111.549 -178.154 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -48.45 146.54 2.86 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.524 -0.762 . . . . 0.0 112.1 -176.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 38.8 ttp180 65.23 30.95 11.08 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.289 -0.869 . . . . 0.0 112.041 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 46.9 t 66.05 35.23 6.43 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.858 0.361 . . . . 0.0 111.538 166.104 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 18.7 mmm180 -97.89 148.24 23.63 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 76.9 mt -113.66 128.55 70.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -178.319 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -138.75 150.31 45.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.535 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.33 169.32 25.89 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 111.494 -0.642 . . . . 0.0 111.494 -175.665 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -125.19 139.87 53.36 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 120.951 0.405 . . . . 0.0 110.909 -177.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 65.5 t90 -106.22 125.39 50.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.533 174.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.464 ' CD2' HG22 ' A' ' 31' ' ' VAL . 67.7 m-85 -117.19 140.31 49.69 Favored 'General case' 0 C--N 1.33 -0.258 0 O-C-N 123.262 0.351 . . . . 0.0 110.539 -179.655 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -50.49 -39.71 49.17 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.908 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -131.72 137.26 48.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.664 0.268 . . . . 0.0 110.372 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 84.3 p -62.28 -42.28 99.21 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.144 -177.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -59.01 -44.19 91.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.431 0.634 . . . . 0.0 109.961 178.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -55.94 -44.22 78.18 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.152 178.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 49.2 t -60.07 -40.65 90.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.594 178.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -59.09 -46.1 89.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.904 0.383 . . . . 0.0 110.634 -176.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.0 mtm180 -61.04 -49.38 77.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.817 -177.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.59 HG23 HD11 ' A' ' 54' ' ' ILE . 26.8 mm -58.65 -44.3 89.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.996 0.427 . . . . 0.0 109.963 -178.433 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.8 m -59.36 -44.19 92.74 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.667 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.59 -44.36 93.92 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 -178.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.492 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.2 mt -59.03 -49.09 79.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.145 0.498 . . . . 0.0 110.607 -178.37 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 56.9 t -58.97 -42.66 86.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.164 -178.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.403 ' OD1' HD12 ' A' ' 86' ' ' LEU . 83.6 m-20 -57.74 -42.75 84.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.881 0.372 . . . . 0.0 110.552 -178.765 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.65 -42.28 99.73 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 -179.215 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.4 mt -62.69 -43.12 99.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.774 0.321 . . . . 0.0 111.105 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 65.4 mt -63.81 -44.91 91.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.458 -176.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 26.6 pttt -71.5 -35.41 70.75 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.508 -177.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 29.0 t -86.48 141.48 29.06 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.758 0.313 . . . . 0.0 110.533 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 65.1 tttm . . . . . 0 C--O 1.221 -0.435 0 CA-C-O 118.045 -0.979 . . . . 0.0 110.572 -179.832 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.35 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -50.76 140.33 37.91 Favored 'Trans proline' 0 N--CA 1.495 1.562 0 C-N-CA 121.294 1.329 . . . . 0.0 112.012 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -115.51 148.58 39.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.493 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -68.29 154.28 94.36 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.537 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.16 -31.16 36.86 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 121.25 1.3 . . . . 0.0 112.259 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 28.8 tp -56.51 -39.8 73.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.864 -179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 26.8 tp -97.56 133.5 42.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.729 -179.232 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 96.8 mm-40 -102.34 145.01 30.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.451 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -59.39 -41.34 89.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.662 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -104.02 138.45 40.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.435 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 60.6 ttm-85 -74.87 123.64 25.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.559 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.62 164.69 14.17 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.535 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -49.5 150.71 8.06 Favored 'Trans proline' 0 N--CA 1.496 1.63 0 C-N-CA 121.339 1.359 . . . . 0.0 111.943 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -60.9 150.79 76.25 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.382 -179.283 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -57.82 128.92 30.93 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 121.134 1.222 . . . . 0.0 111.878 -178.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 96.7 -5.08 64.08 Favored Glycine 0 CA--C 1.534 1.23 0 CA-C-O 119.651 -0.527 . . . . 0.0 113.594 177.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -106.94 117.91 35.31 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 118.278 1.039 . . . . 0.0 110.587 178.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 6.3 ttp -93.08 143.3 26.55 Favored Pre-proline 0 CA--C 1.533 0.307 0 CA-C-O 118.992 -0.528 . . . . 0.0 109.953 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -58.46 143.41 97.89 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 121.169 1.246 . . . . 0.0 111.757 177.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 8.1 p30 -99.46 117.55 34.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.679 -179.336 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 17.7 mt -83.3 151.95 63.64 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.312 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.17 139.87 15.25 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 C-N-CA 121.163 1.242 . . . . 0.0 110.981 173.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 49.0 mmtt -97.11 125.76 44.74 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-O 118.892 -0.575 . . . . 0.0 109.982 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -75.8 154.13 38.58 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 121.392 1.394 . . . . 0.0 111.381 171.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -51.68 152.11 13.5 Favored 'Trans proline' 0 N--CA 1.496 1.633 0 C-N-CA 121.271 1.314 . . . . 0.0 111.621 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.3 tp -50.0 -29.74 9.23 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -177.374 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -55.15 -37.27 66.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.815 0.34 . . . . 0.0 111.223 -177.196 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1345 ' ' TRP . . . . . 0.402 ' HZ2' HD21 ' A' ' 94' ' ' LEU . 35.5 t90 -60.89 -48.03 83.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.181 -177.404 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -61.7 -49.44 76.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.088 0.471 . . . . 0.0 110.482 -177.078 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -59.96 -45.44 92.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.974 -176.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -59.44 -47.33 85.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.713 -175.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.73 -48.56 81.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.823 -176.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -59.54 -44.62 93.17 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.144 -175.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 76.2 mttt -65.37 -47.43 76.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.297 -177.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -55.1 -47.42 74.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.164 -178.185 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 43.0 tp10 -64.95 -37.01 86.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.078 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -67.74 144.57 55.36 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.792 0.33 . . . . 0.0 110.535 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 29.7 tp . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.53 179.969 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.283 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -68.79 145.39 62.65 Favored 'Trans proline' 0 N--CA 1.495 1.604 0 C-N-CA 121.276 1.317 . . . . 0.0 111.937 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -57.18 -42.86 81.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.721 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 43.3 ttm -105.69 147.52 28.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.529 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -137.36 150.78 47.95 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.47 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -95.59 150.77 19.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.622 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 0' ' ' LEU . . . . . 0.529 ' H ' HD12 ' A' ' 0' ' ' LEU . 6.3 mp -59.59 -40.13 86.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.821 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.8 mtp -72.05 151.06 43.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.611 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -57.67 145.69 33.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.53 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -138.66 170.05 16.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.637 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -60.67 -36.44 78.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.096 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.2 t -56.71 -41.25 77.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.954 0.407 . . . . 0.0 110.594 -178.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.2 mm -59.87 -46.07 94.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.133 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.2 m -58.84 -44.71 90.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.449 -177.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -59.7 -45.13 93.05 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.66 -178.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 89.6 mtp -58.25 -42.92 87.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.996 0.427 . . . . 0.0 110.416 -178.436 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -60.13 -49.97 75.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.216 -178.484 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.75 ' HA ' HD12 ' A' ' 14' ' ' ILE . 14.2 tp -61.31 -30.5 70.54 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.631 -0.427 . . . . 0.0 111.342 -179.566 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.57 -49.78 73.89 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 122.219 -0.301 . . . . 0.0 110.505 178.188 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.16 -42.32 85.74 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.032 0.444 . . . . 0.0 110.336 178.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.75 HD12 ' HA ' ' A' ' 11' ' ' LEU . 95.6 mt -54.24 -52.98 33.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.755 178.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -55.62 -26.55 44.71 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -177.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 52.8 mttm -59.98 -30.82 69.37 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -177.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.9 mm -107.63 -42.49 6.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.843 0.354 . . . . 0.0 110.319 -176.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -114.7 84.6 10.35 Favored Pre-proline 0 CA--C 1.533 0.315 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.473 -176.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -53.11 -22.95 20.72 Favored 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 121.528 1.486 . . . . 0.0 113.338 -177.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.2 p90 -97.51 22.07 9.39 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 -175.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -107.89 122.4 46.72 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 171.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.476 ' O ' HD21 ' A' ' 11' ' ' LEU . 46.1 mtmt -116.71 -30.14 5.88 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -174.626 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -128.84 142.25 51.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.763 0.316 . . . . 0.0 110.862 -178.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.474 HG13 HD13 ' A' ' 11' ' ' LEU . 57.6 mt -98.98 132.42 44.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.85 174.127 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 43.6 t -94.41 -47.14 13.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.195 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.504 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.1 t0 -154.05 153.76 32.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.181 178.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.5 p -141.72 131.99 24.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.943 0.401 . . . . 0.0 110.749 178.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 38.3 t -106.98 129.15 54.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.726 176.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.8 m -54.27 -38.22 65.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.252 -172.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -152.73 126.66 9.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.141 0.496 . . . . 0.0 111.759 -178.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 99.3 t -145.19 142.64 22.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.534 -177.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.93 149.89 50.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.68 -0.236 . . . . 0.0 111.022 -179.06 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -98.72 132.58 43.99 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.33 0.586 . . . . 0.0 111.602 -177.145 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -129.54 143.94 51.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.666 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 96.5 m -121.98 149.56 43.29 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -110.91 131.99 54.58 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.997 0.427 . . . . 0.0 110.535 177.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 -104.41 114.91 29.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.811 176.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.1 m -67.84 -32.69 73.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.987 -177.012 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.0 t -60.27 -39.48 86.96 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.719 0.295 . . . . 0.0 110.9 -177.327 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -94.45 -21.42 18.92 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 26.5 t30 69.41 43.78 1.0 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.348 0.594 . . . . 0.0 109.739 -177.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.5 mt-10 -150.43 161.83 41.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.124 -177.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.439 ' CB ' HD12 ' B' 1338 ' ' LEU . 81.8 m95 -94.89 140.0 30.54 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.416 177.579 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -119.75 126.42 51.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.477 . . . . 0.0 109.951 176.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.9 ttpm? -74.4 140.12 44.51 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 178.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 74.3 p -92.25 176.46 6.48 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.412 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -88.36 13.39 11.81 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 45.2 t -108.1 106.42 20.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 121.03 0.443 . . . . 0.0 110.475 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -129.35 112.75 14.16 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 174.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.56 38.96 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 120.114 -1.041 . . . . 0.0 112.237 -168.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.47 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.38 136.42 37.67 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 175.25 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -100.91 126.28 47.53 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.178 -175.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.47 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 6.0 m-85 -129.58 142.25 50.79 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.744 0.307 . . . . 0.0 110.55 177.174 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.658 HD11 HG23 ' A' ' 116' ' ' ILE . 68.9 mt -101.61 126.87 55.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 171.744 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.683 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 14.3 m-30 -108.58 137.48 46.46 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.827 0.346 . . . . 0.0 111.229 -177.096 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 50.9 t60 -112.07 143.25 43.39 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.004 174.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 33.8 tpt85 -142.21 147.89 37.29 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.268 177.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -86.94 28.21 0.93 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.218 -0.447 . . . . 0.0 112.077 -179.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.02 169.79 23.77 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -64.01 125.25 87.58 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.982 -178.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -78.34 140.97 63.2 Favored 'Cis proline' 0 N--CA 1.496 1.642 0 CA-C-N 121.911 1.718 . . . . 0.0 111.843 -1.438 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -61.54 -42.22 98.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.903 -177.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.459 ' HB3' HD12 ' A' ' 80' ' ' ILE . 77.5 m80 -143.63 139.8 29.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.353 0.596 . . . . 0.0 110.891 -177.514 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.3 t -149.9 151.26 33.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.303 -177.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.442 HG13 HD11 ' A' ' 80' ' ' ILE . 48.1 mt -113.47 137.67 45.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 -178.469 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -131.82 142.2 49.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.355 -176.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.4 mt -120.66 130.35 74.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 121.202 0.525 . . . . 0.0 109.662 172.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -96.96 99.56 11.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.937 -1.029 . . . . 0.0 109.205 179.308 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -71.89 107.58 4.72 Favored 'General case' 0 C--N 1.332 -0.181 0 O-C-N 123.666 0.604 . . . . 0.0 111.089 -174.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 78.3 ttt-85 -73.33 -42.41 62.33 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.397 -171.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 48.7 mt -72.27 -45.09 61.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.633 -175.158 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -95.08 -3.22 48.55 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 -175.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 69.7 p 50.93 42.64 28.44 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.511 0.672 . . . . 0.0 111.183 177.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 32.4 m -127.67 135.53 50.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.334 -179.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.3 p -85.36 136.81 33.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.354 -178.14 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -132.71 122.17 24.2 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.347 175.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 13.2 p -125.59 150.31 30.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.209 -178.045 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -148.28 136.37 11.2 Favored Pre-proline 0 CA--C 1.537 0.466 0 CA-C-O 119.106 -0.473 . . . . 0.0 110.567 174.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -75.43 151.01 37.13 Favored 'Trans proline' 0 N--CA 1.498 1.774 0 C-N-CA 121.704 1.602 . . . . 0.0 112.403 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.459 HD12 ' HB3' ' A' ' 63' ' ' HIS . 64.5 mt -90.78 125.44 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.151 177.388 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.414 ' H ' HD11 ' A' ' 84' ' ' LEU . 40.6 p -98.49 160.29 14.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.264 176.655 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -82.35 -22.09 59.36 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 121.218 -0.515 . . . . 0.0 113.124 -176.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.9 p -87.02 10.15 17.39 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -177.123 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.414 HD11 ' H ' ' A' ' 81' ' ' THR . 76.7 mt -66.88 131.82 46.7 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 118.109 0.413 . . . . 0.0 111.098 -177.648 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -112.35 135.8 52.6 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.901 176.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 70.5 mt -119.23 157.83 27.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.023 0.439 . . . . 0.0 111.087 -175.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -144.08 135.71 25.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.473 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.0 t -97.72 109.33 22.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.994 0.426 . . . . 0.0 111.241 -177.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 12.6 mt-30 -106.57 129.22 24.79 Favored Pre-proline 0 CA--C 1.534 0.362 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 173.094 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -79.26 128.95 8.42 Favored 'Trans proline' 0 N--CA 1.494 1.551 0 CA-C-N 120.651 1.268 . . . . 0.0 111.878 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -98.71 19.25 26.22 Favored 'Cis proline' 0 N--CA 1.5 1.889 0 CA-C-N 122.121 1.793 . . . . 0.0 113.026 -6.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -112.58 132.94 54.88 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.713 0.292 . . . . 0.0 111.371 -171.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 35.5 tp -90.22 135.04 33.91 Favored 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.702 -172.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.427 HD11 ' CG2' ' A' ' 102' ' ' ILE . 7.5 tp -123.53 143.01 50.46 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.519 -175.419 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 33.8 p90 -143.38 152.27 41.4 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.835 0.35 . . . . 0.0 110.199 175.266 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 27.0 mtm180 -104.64 144.58 31.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.714 -176.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -129.1 167.76 17.09 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.915 0.864 . . . . 0.0 111.619 -177.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 52.1 tt0 -48.52 149.33 1.68 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.983 -176.286 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 62.05 30.96 18.03 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.212 -0.904 . . . . 0.0 112.172 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 7.5 m 65.11 35.29 8.04 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.842 0.354 . . . . 0.0 111.541 166.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 90.0 mtt-85 -97.48 147.02 24.66 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.65 HD13 ' CH2' ' B' 1345 ' ' TRP . 73.0 mt -115.57 124.19 71.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 -177.449 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 81.1 mtm180 -137.24 150.32 47.76 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -146.6 169.44 27.8 Favored Glycine 0 CA--C 1.523 0.555 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.956 -175.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -125.15 136.53 53.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.165 -0.517 . . . . 0.0 110.534 -178.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 70.4 t90 -106.57 125.82 51.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.597 176.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -113.47 146.36 39.71 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.837 0.351 . . . . 0.0 110.646 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -52.32 -36.13 52.51 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.569 177.235 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 33.1 t-20 -133.21 133.75 43.15 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.786 0.327 . . . . 0.0 110.491 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 22.9 m -61.21 -40.64 94.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.169 -178.049 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -61.0 -43.18 99.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.322 0.582 . . . . 0.0 110.189 179.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -57.0 -45.19 83.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.569 0.699 . . . . 0.0 110.032 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 46.8 t -59.58 -38.56 81.52 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.766 177.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -58.63 -45.52 89.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.888 0.375 . . . . 0.0 110.484 -177.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 64.1 mtp85 -59.74 -48.22 82.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.539 -178.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.658 HG23 HD11 ' A' ' 54' ' ' ILE . 30.5 mm -58.2 -44.97 88.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.093 0.473 . . . . 0.0 110.044 -178.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 54.3 p -59.51 -44.6 93.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.715 -177.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.51 -43.25 94.17 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.655 -0.978 . . . . 0.0 110.655 -178.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.504 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.6 mt -59.07 -49.13 79.06 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.154 0.502 . . . . 0.0 110.552 -178.63 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 53.2 t -58.54 -43.05 86.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.207 -177.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -58.24 -43.86 88.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.643 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.51 -38.99 96.71 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.461 -0.656 . . . . 0.0 111.461 -179.01 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 36.8 mt -65.3 -43.98 89.37 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.624 0.249 . . . . 0.0 111.341 179.484 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 40.8 mt -60.5 -44.55 95.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.078 -176.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -73.33 -37.57 66.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.276 -177.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.7 m -65.73 162.42 18.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.649 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 77.7 tttt . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.5 179.953 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.379 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -66.38 143.08 68.54 Favored 'Trans proline' 0 N--CA 1.496 1.642 0 CA-C-N 119.319 1.56 . . . . 0.0 111.913 -175.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -101.45 145.96 28.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.573 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -77.11 154.19 82.54 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.591 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -76.93 -28.3 6.25 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 121.357 1.371 . . . . 0.0 112.619 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 79.6 mt -56.13 -39.79 72.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.904 -179.32 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 25.9 tp -99.39 127.79 45.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.51 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -124.61 131.52 53.47 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.47 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -64.82 -40.48 95.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.81 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -100.63 158.21 16.1 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.649 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 89.6 mtt180 -110.57 148.28 32.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.498 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -89.32 158.11 46.67 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.398 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 15.4 Cg_endo -57.43 153.63 40.04 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 121.34 1.36 . . . . 0.0 111.541 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 25.9 m-85 -139.63 158.01 69.01 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.933 -178.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -57.89 129.0 31.15 Favored 'Trans proline' 0 N--CA 1.495 1.602 0 C-N-CA 121.174 1.249 . . . . 0.0 111.686 -179.01 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 104.96 -5.16 42.26 Favored Glycine 0 CA--C 1.535 1.325 0 CA-C-O 119.507 -0.607 . . . . 0.0 113.373 179.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -85.88 139.2 31.46 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 118.323 1.061 . . . . 0.0 110.344 175.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 10.4 ttt -61.2 118.13 33.32 Favored Pre-proline 0 CA--C 1.535 0.402 0 CA-C-O 118.669 -0.682 . . . . 0.0 110.255 -178.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -57.43 144.33 92.0 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 121.075 1.183 . . . . 0.0 111.648 175.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 40.1 t30 -97.21 103.31 15.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.602 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1338 ' ' LEU . . . . . 0.439 HD12 ' CB ' ' A' ' 43' ' ' TRP . 17.0 mt -63.75 152.17 87.14 Favored Pre-proline 0 C--N 1.33 -0.279 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.07 139.79 15.36 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 C-N-CA 121.091 1.194 . . . . 0.0 111.158 174.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -97.14 125.88 44.2 Favored Pre-proline 0 CA--C 1.535 0.394 0 CA-C-O 118.442 -0.79 . . . . 0.0 109.706 179.214 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -78.1 167.12 23.88 Favored 'Trans proline' 0 N--CA 1.496 1.63 0 CA-C-N 120.607 1.253 . . . . 0.0 111.813 177.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -61.54 156.35 47.64 Favored 'Trans proline' 0 N--CA 1.494 1.551 0 C-N-CA 121.292 1.328 . . . . 0.0 111.218 177.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 23.8 tp -49.95 -30.15 9.82 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -176.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -56.53 -36.72 69.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.762 0.315 . . . . 0.0 111.388 -176.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1345 ' ' TRP . . . . . 0.65 ' CH2' HD13 ' A' ' 102' ' ' ILE . 5.9 t90 -61.54 -48.19 82.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.851 0.358 . . . . 0.0 110.309 -176.092 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -64.88 -48.66 73.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.041 0.448 . . . . 0.0 110.863 -178.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 61.8 tt0 -58.56 -43.36 89.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.883 -176.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -59.74 -48.16 82.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.597 -176.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -58.21 -47.59 83.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.135 0.493 . . . . 0.0 110.617 -177.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -60.75 -43.14 98.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.295 -176.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 71.3 tttt -62.47 -45.66 92.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.134 -177.033 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 43.5 mt-30 -59.67 -49.0 79.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.946 -178.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -80.92 14.91 2.0 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -104.55 137.57 42.2 Favored 'General case' 0 C--N 1.333 -0.126 0 O-C-N 122.185 -0.322 . . . . 0.0 110.453 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 28.2 tp . . . . . 0 C--O 1.22 -0.478 0 CA-C-O 118.012 -0.995 . . . . 0.0 110.481 179.755 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.229 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -66.44 142.78 66.96 Favored 'Trans proline' 0 N--CA 1.496 1.656 0 CA-C-N 118.911 1.356 . . . . 0.0 111.838 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 29.6 t-80 -58.55 -41.3 85.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.673 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 85.9 mtp -134.78 160.17 39.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.622 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -143.03 153.96 43.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.425 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -79.32 99.94 7.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.556 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 3.8 tt -85.12 -48.3 9.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.462 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.3 mtt -115.97 172.21 7.3 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.449 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -130.35 161.84 30.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.42 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -57.43 142.53 43.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.59 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -62.49 -37.78 87.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.232 -177.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 16.6 t -58.71 -47.28 85.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.078 0.466 . . . . 0.0 110.339 -177.328 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 45.5 mm -59.54 -41.25 84.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.242 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.8 m -60.05 -45.18 93.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.881 0.372 . . . . 0.0 110.631 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 59.9 ttt85 -59.66 -46.98 87.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.993 0.425 . . . . 0.0 110.459 -178.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 86.1 mtp -58.18 -43.13 87.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.232 0.539 . . . . 0.0 110.375 -178.373 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -60.53 -48.3 82.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.33 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.675 ' HA ' HD12 ' A' ' 14' ' ' ILE . 8.4 tp -60.5 -33.63 72.9 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.058 -178.574 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.47 -50.04 73.02 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.655 0.264 . . . . 0.0 110.608 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.16 -41.36 88.19 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.005 0.431 . . . . 0.0 110.553 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.688 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 95.6 mt -54.18 -52.97 32.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.53 178.511 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -53.28 -25.33 14.27 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -177.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 55.6 mttm -59.72 -32.65 70.73 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -177.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.2 mm -108.86 -42.78 5.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.958 0.409 . . . . 0.0 110.253 -177.136 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -117.18 77.32 9.37 Favored Pre-proline 0 CA--C 1.535 0.397 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.912 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -55.35 -20.6 26.22 Favored 'Trans proline' 0 N--CA 1.498 1.774 0 C-N-CA 121.481 1.454 . . . . 0.0 113.431 -175.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.4 p90 -90.6 10.23 26.42 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -174.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.74 126.45 32.4 Favored 'General case' 0 C--O 1.231 0.097 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 175.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -97.9 -40.47 8.48 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.799 -0.361 . . . . 0.0 110.778 -176.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -153.05 156.73 39.3 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.549 -0.461 . . . . 0.0 111.565 -179.47 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 61.8 mt -93.16 138.1 20.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.068 177.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.2 t -90.05 -45.97 15.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.684 176.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.507 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.9 t0 -156.74 157.62 35.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.85 178.09 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.6 p -142.49 132.32 24.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.138 0.494 . . . . 0.0 111.205 -179.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 24.7 t -106.16 124.46 49.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.5 176.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.3 m -54.12 -38.22 65.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.302 -171.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 52.7 t-80 -150.39 126.46 10.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.19 0.519 . . . . 0.0 111.651 -178.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.454 HG21 ' HB3' ' A' ' 52' ' ' PHE . 93.4 t -145.14 138.18 21.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.403 -177.523 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -126.26 149.84 48.82 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.029 -178.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.407 ' HD1' HG21 ' A' ' 46' ' ' THR . 18.9 t80 -98.76 129.99 45.21 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 121.319 0.58 . . . . 0.0 111.682 -176.484 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -125.43 142.86 51.27 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.461 178.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 90.1 m -121.66 146.61 46.83 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -108.37 131.96 54.22 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.929 0.395 . . . . 0.0 110.395 176.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 31.3 t-20 -104.3 116.13 31.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.91 177.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 86.1 p -68.63 -31.89 71.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.966 -177.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.7 m -61.31 -39.36 90.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.777 0.322 . . . . 0.0 110.909 -177.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -93.7 -21.4 19.37 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 28.1 t30 68.96 42.95 1.22 Allowed 'General case' 0 C--O 1.232 0.134 0 CA-C-O 121.299 0.571 . . . . 0.0 109.8 -177.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -151.54 163.99 37.82 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.106 -177.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.441 ' CB ' HD12 ' B' 1338 ' ' LEU . 83.0 m95 -94.92 140.92 29.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.322 177.592 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -122.89 131.34 53.7 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 176.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -76.15 139.79 41.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.278 178.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.407 HG21 ' HD1' ' A' ' 33' ' ' PHE . 66.3 p -92.32 171.99 8.7 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.699 -0.401 . . . . 0.0 109.944 178.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -85.81 13.82 6.79 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 178.122 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.6 t -105.15 106.47 20.57 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 CA-C-O 120.959 0.409 . . . . 0.0 110.464 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -130.34 114.94 16.23 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 175.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.58 176.47 38.91 Favored Glycine 0 CA--C 1.52 0.384 0 C-N-CA 120.065 -1.064 . . . . 0.0 112.372 -169.003 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.465 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -81.64 135.97 35.53 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 175.374 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.454 ' HB3' HG21 ' A' ' 31' ' ' VAL . 7.2 t80 -99.55 128.83 45.67 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.127 -176.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.465 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.2 m-85 -132.08 143.53 50.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.339 177.566 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.665 HD11 HG23 ' A' ' 116' ' ' ILE . 68.9 mt -101.51 128.41 53.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 171.624 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.688 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 14.8 m-30 -108.54 135.56 49.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.007 0.432 . . . . 0.0 111.189 -175.158 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -115.42 142.48 46.65 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.098 176.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -142.07 146.98 36.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.089 178.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -86.87 28.01 0.94 Allowed 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 178.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.36 165.42 34.77 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -63.89 130.34 94.4 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-O 118.563 -0.732 . . . . 0.0 110.206 -177.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -72.84 140.87 69.42 Favored 'Cis proline' 0 N--CA 1.497 1.694 0 CA-C-N 121.717 1.649 . . . . 0.0 111.331 -3.15 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -66.45 -43.47 85.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.025 -177.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.449 ' CD2' HD22 ' A' ' 123' ' ' LEU . 69.3 m80 -141.78 136.63 30.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.296 0.569 . . . . 0.0 110.768 -176.742 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.1 t -151.03 152.25 33.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.476 -178.091 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.466 HG13 HD11 ' A' ' 80' ' ' ILE . 43.9 mt -109.3 140.07 29.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -131.75 141.99 49.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.733 -177.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.4 mt -126.48 130.12 71.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.265 0.555 . . . . 0.0 110.076 173.579 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -97.81 99.86 11.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 114.946 -1.025 . . . . 0.0 109.776 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -73.27 107.12 5.41 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.802 0.689 . . . . 0.0 110.958 -176.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -71.81 -49.2 40.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.456 -171.477 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 44.0 mt -67.49 -45.01 77.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.519 -175.06 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -95.08 -3.0 48.95 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -174.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 11.5 t 44.63 41.39 4.83 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.348 0.594 . . . . 0.0 112.015 178.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 40.1 m -121.25 137.5 54.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.074 -0.967 . . . . 0.0 109.87 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 77.5 p -81.06 132.99 35.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.586 -176.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -119.66 122.16 40.88 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 174.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 38.2 t -125.53 145.81 32.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 120.68 0.276 . . . . 0.0 110.672 -177.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -148.15 126.36 5.96 Favored Pre-proline 0 CA--C 1.538 0.514 0 CA-C-O 118.621 -0.704 . . . . 0.0 110.464 173.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -75.45 150.86 36.87 Favored 'Trans proline' 0 N--CA 1.499 1.838 0 C-N-CA 121.571 1.514 . . . . 0.0 112.316 177.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.466 HD11 HG13 ' A' ' 65' ' ' ILE . 67.3 mt -94.25 135.6 28.1 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-O 120.934 0.397 . . . . 0.0 110.077 177.212 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.5 p -132.1 157.7 43.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.795 177.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -89.57 32.93 4.55 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.286 -178.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t -111.07 -20.56 12.35 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 173.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.6 mt -68.69 146.49 52.93 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.878 0.37 . . . . 0.0 111.133 -176.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -121.78 135.91 54.93 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.847 176.134 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 65.5 mt -113.87 159.0 20.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.698 -177.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -148.01 141.51 25.4 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 177.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.9 t -107.12 109.32 21.13 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.92 0.39 . . . . 0.0 111.209 -178.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -106.79 103.63 47.88 Favored Pre-proline 0 CA--C 1.532 0.277 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 170.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -64.03 145.32 89.53 Favored 'Trans proline' 0 N--CA 1.497 1.722 0 CA-C-N 120.523 1.223 . . . . 0.0 111.85 -170.188 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -93.95 18.43 37.95 Favored 'Cis proline' 0 N--CA 1.498 1.779 0 CA-C-N 120.904 1.358 . . . . 0.0 113.183 -3.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -110.59 159.96 17.09 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 110.342 -0.244 . . . . 0.0 110.342 -176.091 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 31.3 tp -110.76 133.63 53.17 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 122.075 -0.39 . . . . 0.0 111.275 -177.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.459 HD11 ' CG2' ' A' ' 102' ' ' ILE . 9.2 tp -122.08 140.28 52.71 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.141 -174.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 36.2 p90 -143.16 157.83 44.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.776 0.322 . . . . 0.0 110.467 176.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 31.0 mtm105 -101.85 147.33 26.64 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.893 0.378 . . . . 0.0 110.917 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -128.51 160.8 31.19 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.968 0.889 . . . . 0.0 111.619 -177.563 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -48.75 148.97 1.91 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.06 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 43.5 mtp180 64.25 30.9 13.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.252 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 47.8 t 67.62 35.24 4.16 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.94 0.4 . . . . 0.0 111.586 165.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -101.89 151.26 22.31 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.633 HD13 ' CH2' ' B' 1345 ' ' TRP . 74.2 mt -114.1 126.19 71.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -138.06 150.37 46.84 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -148.51 169.46 29.09 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.043 -175.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -125.15 138.84 54.15 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.992 0.425 . . . . 0.0 110.663 -178.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 44.7 t90 -107.05 125.71 51.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.693 176.386 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.407 ' CD2' HG22 ' A' ' 31' ' ' VAL . 60.7 m-85 -111.68 144.4 41.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.827 0.346 . . . . 0.0 110.669 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -52.39 -38.03 57.94 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.553 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 -131.48 134.35 46.07 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.761 0.315 . . . . 0.0 110.494 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.8 m -61.87 -42.46 99.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.064 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -59.84 -43.39 94.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.371 0.605 . . . . 0.0 110.061 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -56.68 -44.22 81.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.509 0.671 . . . . 0.0 110.12 178.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 42.6 t -59.92 -40.27 88.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.675 178.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -59.57 -44.53 93.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.777 0.323 . . . . 0.0 110.674 -177.16 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -59.74 -49.5 77.5 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.011 0.434 . . . . 0.0 110.461 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.665 HG23 HD11 ' A' ' 54' ' ' ILE . 30.3 mm -58.3 -45.02 89.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.14 0.495 . . . . 0.0 110.038 -178.731 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 56.5 p -59.43 -43.51 93.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.733 -177.474 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.62 -43.9 94.13 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 110.653 -0.979 . . . . 0.0 110.653 -178.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.507 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.2 mt -59.12 -49.89 76.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.063 0.458 . . . . 0.0 110.601 -178.341 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 56.9 t -58.93 -42.81 87.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.129 -178.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -57.77 -43.25 85.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.535 -178.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -60.9 -44.97 97.46 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 111.016 -0.833 . . . . 0.0 111.016 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.449 HD22 ' CD2' ' A' ' 63' ' ' HIS . 61.7 mt -57.77 -42.87 84.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.966 0.413 . . . . 0.0 110.488 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 70.4 mt -59.85 -41.89 92.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.686 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 18.1 pttm -97.62 11.21 37.76 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 27.2 t -126.11 139.63 53.22 Favored 'General case' 0 C--O 1.231 0.082 0 O-C-N 122.064 -0.398 . . . . 0.0 110.42 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 67.9 mttm . . . . . 0 C--O 1.221 -0.421 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.606 179.998 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.405 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -64.91 140.91 68.71 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 CA-C-N 119.322 1.561 . . . . 0.0 111.923 -175.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -120.91 148.55 43.9 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.518 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 44.6 m-20 -82.47 156.78 68.33 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.544 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -86.04 27.62 0.58 Allowed 'Trans proline' 0 N--CA 1.492 1.407 0 C-N-CA 121.572 1.514 . . . . 0.0 112.825 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 29.2 tp -62.61 -39.74 94.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.739 0.304 . . . . 0.0 110.779 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.2 mt -78.33 147.29 34.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.509 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -72.43 155.82 39.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.554 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 57.5 tp60 -56.26 -39.93 73.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.802 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 97.4 mm-40 -65.69 146.23 55.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.452 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 32.9 ttp180 -77.98 120.41 22.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.591 -179.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1329 ' ' ALA . . . . . 0.457 ' HB1' ' HD2' ' B' 1330 ' ' PRO . . . -108.57 162.45 19.91 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.329 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B 1330 ' ' PRO . . . . . 0.457 ' HD2' ' HB1' ' B' 1329 ' ' ALA . 9.6 Cg_endo -52.95 160.53 4.06 Favored 'Trans proline' 0 N--CA 1.495 1.559 0 C-N-CA 121.354 1.37 . . . . 0.0 111.601 179.339 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -93.18 99.9 3.65 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 119.132 -0.461 . . . . 0.0 110.494 -179.315 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -58.64 128.98 30.2 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 121.114 1.21 . . . . 0.0 111.6 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 99.59 -5.16 58.4 Favored Glycine 0 CA--C 1.536 1.345 0 CA-C-O 119.566 -0.575 . . . . 0.0 113.4 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -64.55 137.31 57.78 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 118.23 1.015 . . . . 0.0 110.432 178.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 7.8 ttp -92.98 118.13 67.76 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 118.531 -0.747 . . . . 0.0 110.385 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -53.61 141.99 61.89 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 CA-C-N 120.543 1.229 . . . . 0.0 111.744 177.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 40.2 t30 -87.53 107.68 18.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.52 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1338 ' ' LEU . . . . . 0.441 HD12 ' CB ' ' A' ' 43' ' ' TRP . 17.6 mt -68.58 151.3 97.32 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.288 -0.415 . . . . 0.0 109.97 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -79.17 139.86 15.24 Favored 'Trans proline' 0 N--CA 1.492 1.393 0 C-N-CA 121.2 1.267 . . . . 0.0 111.201 174.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -97.03 125.7 45.12 Favored Pre-proline 0 CA--C 1.535 0.377 0 CA-C-O 118.8 -0.619 . . . . 0.0 110.022 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -74.15 155.61 47.1 Favored 'Trans proline' 0 N--CA 1.496 1.636 0 C-N-CA 121.488 1.459 . . . . 0.0 111.774 173.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -53.63 154.68 15.37 Favored 'Trans proline' 0 N--CA 1.496 1.625 0 C-N-CA 121.341 1.361 . . . . 0.0 111.561 177.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1343 ' ' LEU . . . . . 0.541 ' H ' HD12 ' B' 1343 ' ' LEU . 6.2 mp -50.42 -29.63 10.63 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -176.678 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -55.52 -38.58 69.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.865 0.364 . . . . 0.0 111.138 -177.195 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1345 ' ' TRP . . . . . 0.633 ' CH2' HD13 ' A' ' 102' ' ' ILE . 8.9 t90 -60.97 -48.08 83.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.136 -177.336 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -61.29 -49.88 75.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.14 0.495 . . . . 0.0 110.592 -177.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -60.17 -46.21 90.45 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.006 -175.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -58.69 -46.15 87.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.717 -176.057 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.99 -49.32 77.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.881 -177.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -59.15 -43.77 92.07 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.312 -175.173 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 61.0 mttp -67.15 -49.55 64.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.534 -177.057 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 61.3 tt0 -55.08 -49.04 72.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.352 -176.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 65.1 tt0 -68.42 -36.99 79.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.238 -179.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -56.62 141.64 42.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.841 0.353 . . . . 0.0 110.723 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 78.1 mt . . . . . 0 C--O 1.221 -0.426 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.526 -179.982 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.333 0 N-CA-C 109.616 -1.393 . . . . 0.0 109.616 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.98 -33.27 32.95 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 CA-C-N 118.853 1.326 . . . . 0.0 112.072 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -57.11 -41.36 78.82 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.686 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 85.8 mtp -97.44 125.01 41.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.561 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -103.57 132.04 50.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.601 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -93.54 126.88 38.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.5 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 78.5 mt -57.11 -41.6 79.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.618 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.9 mtm -142.55 135.45 28.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.48 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.22 144.75 32.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.608 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -83.58 111.67 19.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.448 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -65.14 -32.99 74.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.608 -179.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.6 m -56.33 -40.79 74.99 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.855 0.36 . . . . 0.0 110.737 -177.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.3 mm -60.64 -47.3 93.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.203 -178.237 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 32.1 m -58.92 -43.67 91.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.531 -177.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -59.62 -45.35 92.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.488 -178.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 66.5 mtt -58.21 -44.35 88.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.117 0.484 . . . . 0.0 110.434 -178.124 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.9 m120 -60.37 -48.91 79.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.383 -178.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.628 ' HA ' HD12 ' A' ' 14' ' ' ILE . 9.4 tp -60.76 -32.89 72.18 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.21 -178.734 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.62 -49.92 73.3 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.638 0.256 . . . . 0.0 110.686 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.87 -41.95 88.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.021 0.439 . . . . 0.0 110.514 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.672 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 93.4 mt -54.27 -52.97 33.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.632 178.177 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -53.84 -20.72 6.23 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -58.29 -34.88 71.02 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 122.266 -0.271 . . . . 0.0 111.589 -178.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.728 HG21 ' CB ' ' A' ' 75' ' ' SER . 46.6 mm -112.97 -39.51 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 CA-C-O 120.757 0.313 . . . . 0.0 110.617 -177.277 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -117.18 77.2 9.29 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.178 -178.47 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -55.99 -21.09 32.59 Favored 'Trans proline' 0 N--CA 1.497 1.735 0 C-N-CA 121.491 1.461 . . . . 0.0 113.432 -175.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 37.2 p90 -89.11 7.05 37.1 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -174.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -80.61 122.67 27.37 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 174.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.0 ttmm -97.71 -40.4 8.59 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.846 -174.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -149.29 152.53 36.05 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.344 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 41.5 mt -93.27 137.18 23.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.875 177.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.1 t -90.21 -45.99 14.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.704 177.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.496 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -156.49 157.08 34.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.908 178.346 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.8 p -142.39 132.79 25.0 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.996 0.426 . . . . 0.0 111.12 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 14.9 t -107.83 126.35 52.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.663 175.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 88.1 p -54.81 -37.94 66.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.343 -171.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -150.31 125.91 10.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.116 0.484 . . . . 0.0 111.724 -178.172 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.449 HG22 ' CD1' ' A' ' 107' ' ' PHE . 95.6 t -145.24 143.67 21.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.774 -177.721 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -131.21 149.48 52.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.866 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -99.22 131.29 45.35 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.261 0.553 . . . . 0.0 111.475 -177.067 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -124.68 139.71 53.6 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.507 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 72.7 m -119.92 146.8 45.45 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 177.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -106.8 132.03 53.23 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 120.983 0.42 . . . . 0.0 110.381 175.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 30.3 t-20 -104.42 115.79 30.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.947 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.0 m -67.54 -33.01 74.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.899 -177.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.3 p -61.63 -38.57 88.17 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 121.023 -0.271 . . . . 0.0 110.916 -177.407 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -93.75 -21.42 19.33 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 69.03 42.5 1.26 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.268 0.556 . . . . 0.0 109.825 -177.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -152.27 165.1 35.95 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.144 -177.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.456 ' CB ' HD12 ' B' 1338 ' ' LEU . 85.8 m95 -93.88 141.42 28.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.357 177.443 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -125.03 126.48 45.47 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 176.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -72.86 141.05 47.95 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 177.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 63.3 p -92.19 177.38 6.17 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.254 -178.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -87.09 14.19 8.0 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 45.2 t -109.28 106.37 20.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 120.966 0.412 . . . . 0.0 110.366 179.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -129.91 111.9 13.01 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 173.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.71 176.49 39.01 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 120.192 -1.004 . . . . 0.0 112.176 -168.181 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.483 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.09 135.43 37.71 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 174.789 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -100.42 128.26 46.53 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 -176.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.483 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.0 m-85 -131.56 143.04 50.08 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.249 177.257 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.638 HD11 HG23 ' A' ' 116' ' ' ILE . 69.6 mt -101.54 127.78 54.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 172.211 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.672 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.8 m-30 -108.48 137.35 46.58 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.984 0.421 . . . . 0.0 111.298 -175.149 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 30.5 t60 -117.78 143.25 46.41 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.173 175.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 62.6 ttt180 -142.03 148.37 38.36 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.093 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -86.95 28.15 0.94 Allowed 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.95 164.76 36.52 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.011 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -64.01 129.47 93.94 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-O 118.491 -0.766 . . . . 0.0 110.012 -177.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.93 140.87 69.71 Favored 'Cis proline' 0 N--CA 1.497 1.71 0 CA-C-N 121.804 1.68 . . . . 0.0 111.693 -1.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -65.61 -44.72 85.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.007 -177.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -142.79 137.37 29.66 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.442 0.639 . . . . 0.0 110.924 -176.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.4 t -150.61 152.3 33.85 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.326 -177.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.432 HG13 HD11 ' A' ' 80' ' ' ILE . 46.1 mt -110.86 138.54 38.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -179.147 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -131.87 141.93 49.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.066 -176.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.1 mt -123.06 133.25 69.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.218 0.532 . . . . 0.0 109.872 172.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -100.77 99.56 10.11 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.553 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.2 t-20 -71.53 108.58 4.99 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 123.716 0.635 . . . . 0.0 111.023 -175.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -74.82 -38.37 62.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.405 -171.604 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 67.0 mt -72.9 -45.17 59.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.46 -175.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 49.5 m-20 -95.12 -3.08 48.67 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -175.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.9 p 51.34 42.39 29.07 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.507 0.67 . . . . 0.0 111.03 178.37 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 40.9 m -127.44 149.07 50.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.812 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.728 ' CB ' HG21 ' A' ' 17' ' ' ILE . 52.7 p -101.86 144.77 30.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.896 0.379 . . . . 0.0 111.292 -177.549 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -138.6 122.25 17.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.189 177.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.7 p -125.55 148.93 30.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.074 -178.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 48.3 tt0 -147.9 136.61 11.5 Favored Pre-proline 0 CA--C 1.537 0.48 0 CA-C-O 119.059 -0.496 . . . . 0.0 110.597 175.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -75.31 150.89 37.5 Favored 'Trans proline' 0 N--CA 1.497 1.733 0 C-N-CA 121.673 1.582 . . . . 0.0 112.435 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.432 HD11 HG13 ' A' ' 65' ' ' ILE . 65.2 mt -90.59 123.69 42.87 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-O 120.935 0.398 . . . . 0.0 110.382 178.34 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.0 p -99.15 160.88 13.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.003 176.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -98.23 6.03 61.37 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 120.972 -0.632 . . . . 0.0 113.683 -177.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 62.7 m -100.34 -0.96 37.33 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.035 0.917 . . . . 0.0 113.034 177.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.1 mt -69.23 139.92 54.5 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-N 118.105 0.412 . . . . 0.0 111.411 -177.454 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.7 tt0 -111.43 135.82 51.45 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.539 174.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 74.4 mt -112.99 156.91 22.22 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.149 0.499 . . . . 0.0 111.371 -175.193 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -142.09 140.0 32.4 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.7 t -104.83 109.1 20.92 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.982 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -106.94 103.69 48.59 Favored Pre-proline 0 C--N 1.329 -0.297 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 170.118 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.1 141.49 48.06 Favored 'Trans proline' 0 N--CA 1.497 1.685 0 CA-C-N 120.627 1.26 . . . . 0.0 111.833 -172.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -90.54 11.74 57.89 Favored 'Cis proline' 0 N--CA 1.498 1.773 0 CA-C-N 121.154 1.448 . . . . 0.0 113.699 -3.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -91.3 170.7 9.77 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.544 0.211 . . . . 0.0 110.806 -177.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 47.4 tp -120.8 135.96 55.02 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 173.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.473 HD11 ' CG2' ' A' ' 102' ' ' ILE . 9.3 tp -127.14 140.02 52.55 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -175.767 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -143.77 155.91 44.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.878 0.371 . . . . 0.0 110.602 175.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 27.5 mtm105 -101.9 146.62 27.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.723 -178.267 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -128.07 163.75 23.91 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.722 0.772 . . . . 0.0 111.385 -177.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -47.31 146.17 2.06 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.227 -177.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 25.1 mmt85 65.12 30.9 11.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.173 -0.922 . . . . 0.0 112.136 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.6 m 66.36 35.17 5.9 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.898 0.38 . . . . 0.0 111.616 166.024 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -99.35 150.06 22.52 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.473 ' CG2' HD11 ' A' ' 94' ' ' LEU . 77.8 mt -114.47 127.76 71.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 121.076 0.465 . . . . 0.0 109.774 -178.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 90.3 mtt180 -137.24 145.91 44.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.412 178.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.85 169.35 25.29 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -125.29 138.77 54.09 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.783 0.325 . . . . 0.0 110.909 -178.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 77.8 t90 -104.09 126.74 51.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.517 175.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.449 ' CD1' HG22 ' A' ' 31' ' ' VAL . 68.6 m-85 -115.6 141.37 48.16 Favored 'General case' 0 C--N 1.33 -0.276 0 O-C-N 123.244 0.34 . . . . 0.0 110.563 -179.203 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -50.68 -37.96 44.08 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.785 178.733 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -133.52 137.29 45.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.305 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.2 t -62.21 -42.36 99.22 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.127 -178.173 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -59.32 -44.29 92.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.425 0.631 . . . . 0.0 110.043 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -56.78 -44.05 81.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.088 178.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 51.8 t -58.93 -39.01 80.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.551 177.08 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -59.09 -46.19 88.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.8 0.333 . . . . 0.0 110.566 -177.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.9 mtm105 -61.4 -49.92 74.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.745 -177.223 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.638 HG23 HD11 ' A' ' 54' ' ' ILE . 28.1 mm -58.54 -43.88 88.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.033 0.444 . . . . 0.0 109.955 -178.55 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 57.3 p -59.81 -44.25 94.1 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.674 -177.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.54 -43.91 93.99 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 -178.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.496 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.5 mt -58.8 -48.67 80.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.142 0.496 . . . . 0.0 110.508 -178.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 54.7 t -59.0 -42.85 87.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.146 -178.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -57.36 -42.66 82.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.915 0.388 . . . . 0.0 110.566 -178.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.68 -43.54 99.12 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.243 -0.743 . . . . 0.0 111.243 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.7 mt -60.76 -42.2 96.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.801 0.334 . . . . 0.0 110.832 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 81.0 mt -62.38 -44.15 97.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.139 -177.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 24.8 pttt -78.46 -21.25 49.35 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -177.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 67.2 m -104.99 148.37 26.79 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.758 0.313 . . . . 0.0 110.521 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 80.5 tttt . . . . . 0 C--O 1.219 -0.521 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.541 179.822 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.353 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.77 142.6 25.01 Favored 'Trans proline' 0 N--CA 1.496 1.646 0 CA-C-N 118.859 1.329 . . . . 0.0 112.037 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -104.36 149.8 25.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.489 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -64.81 153.13 88.84 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.512 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -85.43 86.76 1.02 Allowed 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 121.553 1.502 . . . . 0.0 112.288 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 29.8 tp -58.16 -41.57 84.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.52 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.5 mt -102.86 139.75 38.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.477 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -137.43 166.34 24.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.599 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -56.82 -40.21 75.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.749 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -87.99 178.41 6.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.656 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 95.2 mtt-85 -57.69 141.4 48.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.568 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -77.9 158.53 77.69 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.476 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -66.23 133.22 32.13 Favored 'Trans proline' 0 N--CA 1.496 1.655 0 C-N-CA 121.275 1.317 . . . . 0.0 111.875 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -149.98 159.69 35.1 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.538 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -57.9 129.0 31.17 Favored 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 121.124 1.216 . . . . 0.0 111.741 -178.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 99.27 -5.05 58.84 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-O 119.484 -0.62 . . . . 0.0 113.443 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -92.1 151.6 20.34 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 118.271 1.036 . . . . 0.0 110.596 178.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 3.5 ttp -65.52 120.56 69.19 Favored Pre-proline 0 CA--C 1.536 0.41 0 CA-C-O 118.487 -0.768 . . . . 0.0 110.279 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -50.34 147.86 15.63 Favored 'Trans proline' 0 N--CA 1.498 1.777 0 CA-C-N 120.488 1.21 . . . . 0.0 111.827 178.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 21.3 m120 -100.51 123.04 44.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.586 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1338 ' ' LEU . . . . . 0.456 HD12 ' CB ' ' A' ' 43' ' ' TRP . 14.6 mt -90.6 148.92 39.75 Favored Pre-proline 0 C--N 1.33 -0.273 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -79.14 139.7 15.18 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 C-N-CA 121.177 1.252 . . . . 0.0 111.366 174.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -97.17 125.94 43.95 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-O 118.463 -0.78 . . . . 0.0 109.628 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo -78.1 161.58 29.4 Favored 'Trans proline' 0 N--CA 1.496 1.656 0 C-N-CA 121.187 1.258 . . . . 0.0 111.929 178.281 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -49.91 157.0 2.94 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 C-N-CA 121.345 1.363 . . . . 0.0 111.838 177.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 81.2 mt -49.98 -23.56 2.08 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -177.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -58.33 -36.34 73.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.702 0.286 . . . . 0.0 111.497 -176.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1345 ' ' TRP . . . . . 0.444 ' CH2' HD13 ' A' ' 102' ' ' ILE . 49.1 t90 -65.06 -48.4 73.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.685 -0.234 . . . . 0.0 111.061 -173.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -70.84 -40.13 72.56 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.881 -176.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -61.05 -46.27 91.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.858 0.361 . . . . 0.0 110.578 -179.229 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -59.83 -47.75 84.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.616 -176.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.07 -47.79 83.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.981 0.419 . . . . 0.0 110.773 -177.187 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -60.56 -44.75 95.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.319 -175.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 54.9 mmtt -65.41 -47.07 77.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.373 -177.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -55.46 -48.94 73.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.195 -177.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 43.4 tp10 -65.03 -36.99 86.14 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.141 179.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -79.27 154.63 29.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.817 0.342 . . . . 0.0 110.561 -179.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 78.3 mt . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 118.022 -0.989 . . . . 0.0 110.587 179.857 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.398 0 N-CA-C 110.607 -0.997 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -66.11 -34.31 37.64 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 CA-C-N 119.319 1.56 . . . . 0.0 111.981 -175.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -96.06 -42.55 8.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.526 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 72.2 mtm -108.97 147.4 32.32 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.493 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -85.05 127.95 34.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.584 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -59.97 -38.72 83.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.935 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 79.2 mt -55.95 -39.53 71.86 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.957 -179.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 72.0 mtm -95.92 140.49 30.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.581 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.92 143.43 28.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.571 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -71.41 136.91 47.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.656 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.8 mp0 -69.5 -34.93 75.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.451 -179.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.5 m -57.01 -41.91 79.36 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.876 0.37 . . . . 0.0 110.571 -177.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.9 mm -60.34 -45.11 96.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.133 -178.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.3 m -59.21 -44.75 92.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.924 0.392 . . . . 0.0 110.561 -177.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -60.12 -45.64 92.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.482 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 66.2 mtt -58.13 -42.43 85.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.992 0.425 . . . . 0.0 110.457 -178.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -60.93 -50.52 73.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.251 -178.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.739 ' HA ' HD12 ' A' ' 14' ' ' ILE . 13.1 tp -59.84 -30.34 68.88 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.794 -0.363 . . . . 0.0 111.32 -179.369 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.3 -51.99 60.72 Favored 'General case' 0 C--N 1.332 -0.153 0 O-C-N 122.161 -0.337 . . . . 0.0 110.754 178.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.65 -40.83 80.17 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.027 0.441 . . . . 0.0 110.553 179.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.739 HD12 ' HA ' ' A' ' 11' ' ' LEU . 93.9 mt -54.12 -53.01 31.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.608 178.716 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -51.9 -25.19 7.52 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -178.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -59.26 -34.37 72.16 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -177.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.5 mm -106.53 -44.79 7.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.112 0.482 . . . . 0.0 109.938 -177.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -117.2 77.49 9.57 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.628 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -55.05 -20.66 24.3 Favored 'Trans proline' 0 N--CA 1.497 1.704 0 C-N-CA 121.491 1.461 . . . . 0.0 113.631 -174.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.3 p90 -89.03 2.06 54.61 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -174.21 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -78.59 130.23 35.69 Favored 'General case' 0 C--O 1.231 0.093 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 175.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -108.84 -39.25 5.39 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.025 -174.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.3 tt0 -131.63 146.03 51.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.995 0.426 . . . . 0.0 111.137 -175.298 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.467 HG13 HD13 ' A' ' 11' ' ' LEU . 58.7 mt -100.54 132.07 46.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.681 172.395 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.1 t -91.59 -47.12 14.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.098 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.516 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -157.22 157.51 34.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.953 178.871 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 64.2 p -143.64 132.24 22.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.119 0.485 . . . . 0.0 111.234 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.6 t -107.05 126.59 52.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.551 176.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.6 m -54.54 -38.87 67.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.313 -172.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -149.81 126.6 11.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.119 0.485 . . . . 0.0 111.68 -178.076 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.424 HG21 ' HB3' ' A' ' 52' ' ' PHE . 93.8 t -145.22 140.53 22.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.09 -0.959 . . . . 0.0 109.531 -177.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.56 149.84 51.15 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.684 0.278 . . . . 0.0 111.203 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.527 ' CD2' HG21 ' A' ' 46' ' ' THR . 14.2 t80 -98.5 131.03 45.07 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.365 0.602 . . . . 0.0 111.798 -176.251 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -127.5 140.41 52.16 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.199 177.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.3 m -121.66 145.49 47.95 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -109.15 131.0 55.48 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.913 0.387 . . . . 0.0 110.344 177.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -101.94 115.21 30.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.835 176.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 85.4 p -68.71 -31.35 70.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.998 -0.547 . . . . 0.0 112.015 -177.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.1 m -62.44 -37.81 87.32 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.652 0.263 . . . . 0.0 111.076 -178.092 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -95.59 -21.45 18.23 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -178.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 54.8 t30 69.4 46.08 0.79 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.524 0.678 . . . . 0.0 109.425 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 74.5 tt0 -155.06 151.46 28.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.058 -177.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.425 ' CB ' HD12 ' B' 1338 ' ' LEU . 85.6 m95 -88.18 141.85 28.23 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.307 176.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -121.93 129.01 52.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.881 176.21 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -74.53 136.92 42.15 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 178.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.527 HG21 ' CD2' ' A' ' 33' ' ' PHE . 71.5 p -92.3 169.88 10.24 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.188 -178.687 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.4 p-10 -83.12 11.13 6.78 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.8 t -101.62 106.47 19.7 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-O 120.934 0.397 . . . . 0.0 110.287 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -131.51 111.37 11.71 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 175.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.63 176.57 38.94 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.015 -1.088 . . . . 0.0 112.307 -168.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.485 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -80.6 134.9 35.97 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 174.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.424 ' HB3' HG21 ' A' ' 31' ' ' VAL . 5.4 t80 -99.21 128.37 45.33 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 -176.178 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.485 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.2 m-85 -132.52 143.05 49.48 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.341 177.418 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.649 HD11 HG23 ' A' ' 116' ' ' ILE . 68.9 mt -101.59 127.71 54.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 172.532 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.66 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 15.3 m-30 -108.44 138.29 44.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.845 0.355 . . . . 0.0 111.608 -176.006 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 64.1 t60 -114.66 143.37 45.14 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.283 174.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 29.3 ttp180 -141.46 152.35 44.15 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.481 177.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -86.95 28.19 0.93 Allowed 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.844 -0.617 . . . . 0.0 112.14 -178.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -155.45 152.15 28.64 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -63.98 133.51 95.61 Favored Pre-proline 0 CA--C 1.541 0.598 0 CA-C-O 118.456 -0.783 . . . . 0.0 110.323 -176.264 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -68.29 140.85 57.98 Favored 'Cis proline' 0 N--CA 1.498 1.746 0 CA-C-N 121.672 1.633 . . . . 0.0 111.409 -0.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -66.61 -38.78 87.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.253 -176.371 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -141.44 141.11 33.72 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.683 0.754 . . . . 0.0 111.122 -176.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.6 t -149.8 151.31 33.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.912 -178.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 50.4 mt -109.82 140.46 28.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.456 ' HD1' HG22 ' A' ' 77' ' ' VAL . 64.9 t80 -131.79 142.11 49.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.578 -177.446 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 58.9 mt -123.49 128.62 74.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.186 0.517 . . . . 0.0 109.894 172.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -94.07 99.54 11.82 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.171 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -75.45 106.85 7.2 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.65 0.594 . . . . 0.0 111.045 -174.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.413 HH21 ' HB2' ' A' ' 51' ' ' ALA . 98.6 mtt180 -72.45 -43.49 63.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.565 -171.572 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 67.3 mt -70.8 -45.17 65.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.731 -174.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 37.2 m-20 -95.09 -3.29 48.38 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -175.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.3 p 50.35 42.29 25.76 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.511 0.672 . . . . 0.0 111.257 177.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.5 m -127.16 145.93 50.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.232 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 97.5 p -88.24 132.64 34.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.248 -178.567 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -123.07 122.26 38.05 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 174.357 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.456 HG22 ' HD1' ' A' ' 66' ' ' PHE . 26.3 t -125.42 148.0 30.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 120.764 0.316 . . . . 0.0 110.946 -175.042 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -148.73 126.48 5.73 Favored Pre-proline 0 CA--C 1.539 0.552 0 CA-C-O 118.678 -0.677 . . . . 0.0 110.495 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -75.49 151.0 36.87 Favored 'Trans proline' 0 N--CA 1.499 1.836 0 C-N-CA 121.408 1.405 . . . . 0.0 112.05 177.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 70.3 mt -91.44 112.29 25.18 Favored 'Isoleucine or valine' 0 C--O 1.231 0.125 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.472 179.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 66.0 p -98.94 153.34 18.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.842 175.563 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -96.59 32.5 6.47 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.355 -178.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.0 m -111.05 -19.13 12.86 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 173.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.9 mt -68.81 145.69 53.53 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.914 0.388 . . . . 0.0 111.452 -175.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 54.8 tt0 -111.76 136.12 51.46 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.819 175.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.439 HD12 ' ND2' ' A' ' 121' ' ' ASN . 64.2 mt -110.97 158.64 18.55 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.709 -177.219 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -149.52 142.95 25.3 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.292 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.1 t -100.38 109.18 21.34 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.476 179.043 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 23.7 mm-40 -106.61 103.67 47.52 Favored Pre-proline 0 C--N 1.329 -0.296 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 173.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -67.5 141.15 54.64 Favored 'Trans proline' 0 N--CA 1.497 1.724 0 CA-C-N 120.512 1.219 . . . . 0.0 111.919 -171.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -90.6 11.14 59.37 Favored 'Cis proline' 0 N--CA 1.499 1.818 0 CA-C-N 121.173 1.455 . . . . 0.0 113.667 -5.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -92.3 170.33 9.88 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.516 0.326 . . . . 0.0 110.67 -176.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 56.2 tp -115.59 134.48 55.02 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 173.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 12.0 tp -127.58 140.23 52.25 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 -173.631 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -148.17 155.52 41.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.849 0.357 . . . . 0.0 110.477 175.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.2 mtm105 -104.71 147.97 27.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.947 -176.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -128.67 167.34 17.36 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.944 0.878 . . . . 0.0 111.339 -178.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -47.77 148.48 1.55 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.195 -0.912 . . . . 0.0 112.188 -177.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 62.82 30.96 16.65 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.134 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.2 p 65.34 35.33 7.61 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.758 0.313 . . . . 0.0 111.638 166.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 68.5 mtp180 -98.0 147.21 24.73 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 76.9 mt -111.65 127.05 69.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 -177.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -134.26 147.96 50.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.451 -179.117 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.39 166.43 26.81 Favored Glycine 0 CA--C 1.524 0.652 0 C-N-CA 120.901 -0.666 . . . . 0.0 111.621 -178.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -125.27 140.78 52.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.24 -0.48 . . . . 0.0 110.213 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 83.9 t90 -107.42 128.98 54.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.652 175.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -115.46 144.24 44.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.806 0.336 . . . . 0.0 110.76 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -52.1 -35.92 49.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.568 177.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -135.44 135.69 40.75 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.814 0.34 . . . . 0.0 110.487 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.7 t -62.58 -42.32 99.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.188 -177.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -59.44 -43.88 93.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.412 0.625 . . . . 0.0 110.099 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -56.42 -45.55 80.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.077 179.181 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 41.3 t -60.47 -38.59 84.71 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.858 178.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -59.14 -45.57 90.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.829 0.347 . . . . 0.0 110.488 -177.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 -60.58 -48.52 81.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.574 -178.157 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.649 HG23 HD11 ' A' ' 54' ' ' ILE . 28.5 mm -58.24 -44.94 89.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.044 0.45 . . . . 0.0 109.982 -178.897 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 57.8 p -59.35 -44.01 92.73 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.692 -177.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.62 -43.96 94.11 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.516 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.7 mt -58.74 -48.6 80.62 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.136 0.493 . . . . 0.0 110.502 -178.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 48.9 t -58.73 -44.12 89.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.141 -178.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.439 ' ND2' HD12 ' A' ' 86' ' ' LEU . 31.3 m120 -58.51 -41.9 86.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.828 -178.543 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.58 -42.94 99.64 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 111.411 -0.676 . . . . 0.0 111.411 -178.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 47.5 mt -63.29 -43.0 99.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.801 0.334 . . . . 0.0 111.172 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 25.4 mt -64.65 -44.91 88.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.591 -176.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 12.4 pttp -71.88 -37.56 70.15 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.522 -176.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 29.3 t -139.92 153.46 46.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.933 0.397 . . . . 0.0 110.779 -178.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 36.8 tttp . . . . . 0 C--O 1.221 -0.446 0 CA-C-O 117.926 -1.035 . . . . 0.0 110.738 -179.805 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.339 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -68.96 144.03 56.85 Favored 'Trans proline' 0 N--CA 1.496 1.655 0 C-N-CA 121.318 1.346 . . . . 0.0 111.878 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -97.78 118.34 34.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.569 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -83.16 154.75 67.06 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.548 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -86.94 30.63 0.47 Allowed 'Trans proline' 0 N--CA 1.491 1.357 0 C-N-CA 121.704 1.602 . . . . 0.0 112.499 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 78.1 mt -60.59 -39.06 86.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.883 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 27.2 tp -87.94 133.19 33.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.6 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -75.96 140.65 42.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.617 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -60.27 -39.77 88.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.875 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -94.8 120.79 35.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.668 -179.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 41.6 ttt85 -113.12 135.22 54.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.301 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -100.16 155.81 35.99 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.707 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -73.09 142.72 34.8 Favored 'Trans proline' 0 N--CA 1.494 1.558 0 C-N-CA 121.304 1.336 . . . . 0.0 111.897 179.324 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 33.0 p90 -146.36 153.5 48.18 Favored Pre-proline 0 C--O 1.234 0.255 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.023 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.97 130.02 36.17 Favored 'Trans proline' 0 N--CA 1.495 1.56 0 C-N-CA 121.13 1.22 . . . . 0.0 111.543 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 105.0 -5.13 42.06 Favored Glycine 0 CA--C 1.533 1.209 0 CA-C-O 119.47 -0.628 . . . . 0.0 113.426 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -60.97 156.01 18.66 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 118.417 1.108 . . . . 0.0 110.246 174.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 5.5 ttt -61.16 118.15 33.31 Favored Pre-proline 0 CA--C 1.536 0.417 0 CA-C-O 118.497 -0.763 . . . . 0.0 110.38 -178.212 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -68.13 158.39 57.67 Favored 'Trans proline' 0 N--CA 1.497 1.702 0 C-N-CA 121.191 1.261 . . . . 0.0 111.755 177.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 42.4 t30 -91.57 110.51 21.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.622 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1338 ' ' LEU . . . . . 0.425 HD12 ' CB ' ' A' ' 43' ' ' TRP . 26.6 mt -74.7 133.8 76.26 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 118.425 -0.797 . . . . 0.0 109.736 179.242 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -79.14 139.61 15.12 Favored 'Trans proline' 0 N--CA 1.494 1.532 0 CA-C-N 120.401 1.179 . . . . 0.0 111.16 174.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 26.3 mtmt -97.26 125.97 43.63 Favored Pre-proline 0 CA--C 1.535 0.384 0 CA-C-O 118.462 -0.78 . . . . 0.0 110.35 178.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -63.64 162.33 28.48 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 CA-C-N 120.697 1.284 . . . . 0.0 111.515 176.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -49.82 156.68 3.09 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 121.316 1.344 . . . . 0.0 111.739 178.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 82.0 mt -50.04 -28.81 7.6 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -176.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 64.0 t80 -55.69 -37.56 68.51 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.814 0.34 . . . . 0.0 111.205 -177.05 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 52.9 t90 -60.96 -48.13 83.26 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.425 -176.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -63.64 -48.89 75.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.035 0.445 . . . . 0.0 110.618 -178.009 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.29 -42.42 91.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.017 -176.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -59.37 -49.39 77.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.88 0.371 . . . . 0.0 110.592 -176.21 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.21 -49.44 77.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.771 -177.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -59.44 -40.97 88.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.331 -175.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 83.2 tttt -66.47 -48.11 70.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.364 -177.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -55.0 -49.07 72.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.233 -177.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -68.19 -35.4 77.94 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.42 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -63.96 143.48 57.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.825 0.345 . . . . 0.0 110.639 -178.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1355 ' ' LEU . . . . . 0.475 ' C ' HD23 ' B' 1355 ' ' LEU . 6.6 tt . . . . . 0 C--O 1.221 -0.444 0 CA-C-O 117.96 -1.019 . . . . 0.0 110.496 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.316 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -51.48 -30.81 36.64 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 121.295 1.33 . . . . 0.0 112.309 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -56.26 -42.67 77.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.79 -179.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 85.2 mtp -111.32 144.73 40.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.501 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -146.75 152.58 39.04 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.57 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -85.13 112.61 20.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.573 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 78.9 mt -60.65 -41.5 95.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.623 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.5 mtm -141.13 136.35 31.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.602 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -115.53 151.94 33.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.462 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -132.09 107.41 8.62 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.47 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -61.52 -31.65 71.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.68 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.8 m -55.88 -40.48 73.05 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.932 0.396 . . . . 0.0 110.809 -177.139 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.3 mm -60.67 -47.72 91.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.13 -178.257 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.7 m -58.45 -43.43 88.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.466 -177.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -60.02 -45.76 91.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.644 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 89.7 mtp -58.21 -43.06 87.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.04 0.448 . . . . 0.0 110.448 -178.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -60.69 -50.16 74.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.298 -178.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.729 ' HA ' HD12 ' A' ' 14' ' ' ILE . 14.1 tp -60.66 -30.77 70.1 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.276 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.15 -50.7 69.38 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 122.276 -0.265 . . . . 0.0 110.601 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.97 -41.67 83.43 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.001 0.429 . . . . 0.0 110.424 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.729 HD12 ' HA ' ' A' ' 11' ' ' LEU . 94.4 mt -54.23 -52.94 33.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.594 178.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -53.95 -24.38 16.3 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.223 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -59.25 -33.22 70.76 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.0 mm -107.9 -42.09 5.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.765 0.317 . . . . 0.0 110.298 -177.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 35.9 t0 -115.11 85.47 12.42 Favored Pre-proline 0 CA--C 1.533 0.323 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.709 -175.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -53.75 -24.4 30.28 Favored 'Trans proline' 0 N--CA 1.497 1.709 0 C-N-CA 121.421 1.414 . . . . 0.0 113.319 -177.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.6 p90 -95.5 19.56 10.81 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 -175.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -101.94 118.21 36.43 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 172.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.45 ' O ' HD21 ' A' ' 11' ' ' LEU . 70.3 mmtt -112.98 -33.51 6.03 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -173.386 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -127.91 142.47 51.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.842 0.354 . . . . 0.0 110.684 -178.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.478 HG13 HD13 ' A' ' 11' ' ' LEU . 57.8 mt -99.43 129.78 49.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.827 173.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.9 t -90.57 -47.23 14.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.268 -0.423 . . . . 0.0 109.943 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.489 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.9 t0 -154.37 154.42 33.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.991 178.425 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 58.7 p -142.29 131.95 24.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.045 0.45 . . . . 0.0 111.009 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 38.5 t -107.58 126.61 52.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.682 177.151 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 86.7 p -54.59 -38.05 66.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.232 -172.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 61.0 t-80 -151.15 126.06 9.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.256 0.55 . . . . 0.0 111.523 -179.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.44 HG22 ' CD2' ' A' ' 107' ' ' PHE . 99.6 t -144.86 142.18 23.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.44 -178.018 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -130.53 149.76 52.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.09 -178.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.575 ' CD2' HG21 ' A' ' 46' ' ' THR . 13.7 t80 -97.12 131.02 44.3 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.275 0.559 . . . . 0.0 111.588 -177.401 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.422 ' CD1' HD11 ' B' 1338 ' ' LEU . 34.5 m-85 -124.42 141.18 52.28 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.585 178.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 92.2 m -122.34 145.08 48.59 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 177.389 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -108.03 130.45 55.07 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 120.893 0.378 . . . . 0.0 110.313 177.033 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -101.29 114.86 29.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.784 176.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 27.1 m -67.49 -32.94 74.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.842 -177.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.0 m -61.47 -38.41 87.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.635 0.255 . . . . 0.0 111.006 -177.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -94.58 -21.5 18.8 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -178.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 25.8 t30 68.81 45.53 0.99 Allowed 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.426 0.631 . . . . 0.0 109.438 -177.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 78.2 tt0 -154.05 150.95 28.76 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.083 -176.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.416 ' CB ' HD12 ' B' 1338 ' ' LEU . 89.4 m95 -86.51 142.02 28.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.255 176.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -125.04 134.09 52.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.34 -0.391 . . . . 0.0 109.99 176.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -75.53 140.95 43.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.287 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.575 HG21 ' CD2' ' A' ' 33' ' ' PHE . 62.6 p -92.39 172.36 8.44 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.066 178.747 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -83.86 12.61 5.84 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.9 t -108.41 106.49 20.79 Favored 'Isoleucine or valine' 0 C--O 1.231 0.123 0 CA-C-O 121.067 0.46 . . . . 0.0 110.43 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -129.96 112.63 13.69 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 173.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.61 176.49 38.93 Favored Glycine 0 CA--C 1.52 0.391 0 C-N-CA 120.192 -1.004 . . . . 0.0 112.354 -168.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.5 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.75 134.79 37.02 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 175.226 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -100.04 126.9 46.31 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.146 -175.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.5 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 7.3 m-85 -131.52 142.16 49.89 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.767 0.318 . . . . 0.0 110.537 177.059 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.621 HD11 HG23 ' A' ' 116' ' ' ILE . 67.7 mt -101.68 126.72 55.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 172.35 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.685 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 14.0 m-30 -108.46 137.69 46.01 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.826 0.346 . . . . 0.0 111.343 -176.413 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 58.1 t60 -114.11 143.29 45.03 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.368 175.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.8 tpt180 -142.09 147.53 36.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.427 175.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.8 m120 -86.79 28.17 0.92 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.25 171.32 20.41 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -63.98 124.75 86.2 Favored Pre-proline 0 CA--C 1.539 0.535 0 CA-C-O 118.439 -0.791 . . . . 0.0 110.021 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -78.73 140.93 61.65 Favored 'Cis proline' 0 N--CA 1.498 1.746 0 CA-C-N 121.994 1.748 . . . . 0.0 111.906 -0.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -63.83 -46.53 84.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.096 -177.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.465 ' HB3' HD12 ' A' ' 80' ' ' ILE . 77.0 m80 -143.15 138.66 29.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.341 0.591 . . . . 0.0 110.992 -176.778 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.6 t -150.18 152.06 34.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.37 -178.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.426 HG13 HD11 ' A' ' 80' ' ' ILE . 50.8 mt -114.48 137.14 48.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 -178.148 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -131.91 142.19 49.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.537 -176.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 62.2 mt -120.4 129.93 75.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.2 0.524 . . . . 0.0 109.706 172.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -96.13 99.55 11.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.981 -1.009 . . . . 0.0 109.322 179.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.3 t-20 -71.79 106.28 4.09 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 123.669 0.605 . . . . 0.0 111.062 -174.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -74.01 -40.07 63.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.252 -171.314 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 72.9 mt -72.05 -45.19 61.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.648 -174.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 60.9 m-20 -95.11 -3.32 48.25 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 -175.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.437 ' O ' HG22 ' A' ' 73' ' ' THR . 13.3 m 55.6 43.18 28.66 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-O 121.493 0.663 . . . . 0.0 110.561 177.716 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.6 m -127.52 148.9 50.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.56 -177.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.9 p -99.2 135.36 40.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.322 -179.69 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -131.91 122.23 25.3 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.673 0.273 . . . . 0.0 110.266 175.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.7 p -125.54 149.88 30.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.094 -177.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 26.4 tp10 -147.36 133.95 9.88 Favored Pre-proline 0 CA--C 1.538 0.509 0 CA-C-O 118.861 -0.59 . . . . 0.0 110.302 174.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.42 150.94 37.1 Favored 'Trans proline' 0 N--CA 1.498 1.765 0 C-N-CA 121.54 1.494 . . . . 0.0 112.301 179.029 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.465 HD12 ' HB3' ' A' ' 63' ' ' HIS . 63.7 mt -89.47 139.5 17.36 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.19 177.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.1 p -132.09 156.88 45.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.867 177.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -98.16 37.71 3.37 Favored Glycine 0 CA--C 1.524 0.6 0 C-N-CA 121.0 -0.619 . . . . 0.0 111.832 -178.603 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 51.6 p -111.07 -23.19 11.06 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 174.363 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.8 mt -69.09 145.82 53.1 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.977 0.418 . . . . 0.0 111.502 -175.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 57.0 tt0 -113.66 135.92 53.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.556 175.08 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 68.9 mt -111.12 160.0 17.31 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.99 0.424 . . . . 0.0 110.978 -175.687 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -149.52 140.76 23.12 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.219 -0.659 . . . . 0.0 109.219 178.188 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.5 t -99.12 109.19 21.93 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.871 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -106.8 103.81 48.7 Favored Pre-proline 0 C--N 1.329 -0.307 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 172.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -71.67 139.87 34.77 Favored 'Trans proline' 0 N--CA 1.497 1.708 0 CA-C-N 120.501 1.215 . . . . 0.0 112.047 -171.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -88.99 9.49 64.49 Favored 'Cis proline' 0 N--CA 1.501 1.926 0 CA-C-N 121.22 1.471 . . . . 0.0 113.684 -4.128 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -84.61 170.41 13.4 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.775 0.321 . . . . 0.0 110.986 -177.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.1 tp -118.84 133.34 55.9 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 170.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.421 HD11 ' CG2' ' A' ' 102' ' ' ILE . 10.9 tp -126.01 141.01 52.14 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.538 0.209 . . . . 0.0 110.499 -174.409 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 15.3 p90 -147.4 156.37 42.82 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.799 0.333 . . . . 0.0 110.382 176.276 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.7 mtm105 -101.93 144.24 30.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.97 0.414 . . . . 0.0 110.734 -178.039 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -124.95 162.84 23.59 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.738 0.78 . . . . 0.0 111.446 -176.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -47.75 146.21 2.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.164 -177.102 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 65.36 30.92 10.81 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.067 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 43.1 t 66.17 35.19 6.24 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.863 0.363 . . . . 0.0 111.7 164.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.9 mtt-85 -102.93 152.76 20.94 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.469 HD13 ' CH2' ' B' 1345 ' ' TRP . 81.4 mt -111.99 127.75 68.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-O 121.075 0.464 . . . . 0.0 109.813 -176.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 80.4 mtt180 -130.25 147.13 51.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.463 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -142.61 166.29 26.56 Favored Glycine 0 CA--C 1.523 0.537 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 -178.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -126.05 140.84 52.27 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.742 0.306 . . . . 0.0 110.749 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 13.5 t90 -108.5 128.27 54.65 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.608 175.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.44 ' CD2' HG22 ' A' ' 31' ' ' VAL . 58.3 m-85 -117.54 144.22 45.32 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.769 0.319 . . . . 0.0 110.631 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -52.4 -36.79 54.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.582 178.212 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 39.1 t-20 -134.01 135.05 43.15 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.757 0.313 . . . . 0.0 110.511 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.3 p -61.92 -41.39 97.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.172 -177.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -60.69 -43.18 98.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.421 0.629 . . . . 0.0 110.159 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -56.53 -45.31 81.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.579 0.704 . . . . 0.0 109.99 178.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 42.1 t -60.01 -39.27 85.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.705 178.02 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -58.72 -44.91 90.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.907 0.384 . . . . 0.0 110.545 -177.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -60.25 -48.77 80.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.593 -177.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.621 HG23 HD11 ' A' ' 54' ' ' ILE . 31.0 mm -58.51 -45.45 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.064 0.459 . . . . 0.0 109.979 -178.538 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.5 p -59.7 -43.78 93.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.733 -177.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.72 -43.79 94.36 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 -178.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.489 HD13 ' HB2' ' A' ' 26' ' ' ASP . 10.3 mt -59.15 -48.92 79.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.054 0.454 . . . . 0.0 110.616 -178.167 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 58.7 t -59.21 -43.13 88.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.056 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 27.3 m120 -57.54 -42.55 83.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.6 -178.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.79 -45.44 96.21 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 -179.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 27.4 mt -58.56 -42.21 87.4 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.876 0.37 . . . . 0.0 110.594 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 80.6 mt -58.74 -41.0 85.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.638 179.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 34.5 pttt -95.93 11.16 34.86 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 33.3 t -132.03 142.93 49.72 Favored 'General case' 0 C--O 1.231 0.088 0 O-C-N 122.112 -0.367 . . . . 0.0 110.451 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 47.7 pttt . . . . . 0 C--O 1.219 -0.513 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.785 -179.786 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.383 0 N-CA-C 110.636 -0.986 . . . . 0.0 110.636 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -64.8 140.52 67.62 Favored 'Trans proline' 0 N--CA 1.496 1.618 0 CA-C-N 119.346 1.573 . . . . 0.0 111.924 -175.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -109.86 146.94 34.24 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.562 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -83.05 161.02 59.09 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.504 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -61.55 -30.58 86.37 Favored 'Trans proline' 0 N--CA 1.498 1.75 0 C-N-CA 121.244 1.296 . . . . 0.0 112.227 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 28.9 tp -56.31 -39.44 72.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.837 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.4 mt -79.79 148.32 31.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.481 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -69.32 140.96 54.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.593 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -58.65 -40.57 83.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.78 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -69.72 144.88 52.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.604 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 61.5 ttt180 -92.13 132.46 36.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.529 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -84.19 156.27 63.3 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.561 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -66.49 143.14 68.02 Favored 'Trans proline' 0 N--CA 1.496 1.638 0 C-N-CA 121.246 1.297 . . . . 0.0 111.796 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -129.06 99.89 21.31 Favored Pre-proline 0 CA--C 1.533 0.301 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.526 -179.464 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -57.89 128.92 30.83 Favored 'Trans proline' 0 N--CA 1.496 1.624 0 C-N-CA 121.05 1.167 . . . . 0.0 111.615 177.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 88.13 7.8 72.96 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 121.202 -0.523 . . . . 0.0 113.299 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -53.2 148.62 8.14 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 118.239 1.019 . . . . 0.0 111.185 178.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 19.7 ttp -61.09 144.89 90.45 Favored Pre-proline 0 CA--C 1.534 0.33 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.204 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 25.9 Cg_exo -60.94 148.83 91.42 Favored 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 121.244 1.296 . . . . 0.0 111.424 175.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -102.3 99.9 10.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.683 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1338 ' ' LEU . . . . . 0.422 HD11 ' CD1' ' A' ' 34' ' ' TYR . 12.0 mt -66.27 150.56 96.87 Favored Pre-proline 0 C--N 1.329 -0.288 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.1 139.74 15.28 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 C-N-CA 121.09 1.193 . . . . 0.0 111.257 175.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 12.1 mmmt -97.13 125.74 44.74 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-O 118.783 -0.627 . . . . 0.0 110.011 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -74.2 155.22 46.91 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 121.396 1.397 . . . . 0.0 111.565 172.341 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -50.66 157.02 3.83 Favored 'Trans proline' 0 N--CA 1.495 1.569 0 C-N-CA 121.236 1.291 . . . . 0.0 111.721 178.464 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 82.4 mt -50.04 -26.93 4.84 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 57.1 t80 -55.15 -38.13 67.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.892 0.377 . . . . 0.0 111.086 -177.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1345 ' ' TRP . . . . . 0.469 ' CH2' HD13 ' A' ' 102' ' ' ILE . 46.3 t90 -61.12 -48.04 83.49 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.298 -177.651 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -60.07 -46.87 88.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.97 0.414 . . . . 0.0 110.421 -177.558 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -60.41 -43.75 96.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.955 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -59.14 -45.59 90.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.773 -177.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -62.59 -52.91 61.54 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.858 -176.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -61.15 -35.72 77.85 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.482 -176.082 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 22.8 ttpt -66.05 -49.75 66.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.707 0.289 . . . . 0.0 111.016 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -55.33 -44.49 75.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.04 -178.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 42.8 tp10 -64.86 -37.11 86.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.994 178.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -75.5 143.93 42.27 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.784 0.326 . . . . 0.0 110.542 179.296 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 25.4 tp . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.563 179.997 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -64.27 -30.78 63.98 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 CA-C-N 119.22 1.51 . . . . 0.0 112.231 -175.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -56.0 -39.97 72.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.898 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 65.2 mtt -94.31 149.39 21.29 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.682 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -142.11 157.18 45.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.442 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 18.4 p30 -94.04 154.6 17.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.727 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 0' ' ' LEU . . . . . 0.515 ' N ' HD12 ' A' ' 0' ' ' LEU . 6.6 mp -67.39 -40.31 85.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.754 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.6 mtp -95.0 136.07 35.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.562 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.59 128.82 44.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.536 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -83.68 147.45 27.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.577 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -60.3 -35.34 75.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.281 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.8 t -57.16 -42.91 81.98 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.043 0.449 . . . . 0.0 110.507 -177.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.4 mm -59.69 -44.53 93.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.18 -178.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.3 m -59.48 -44.97 92.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.449 -177.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -59.55 -45.27 92.31 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.52 -178.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 88.5 mtp -58.22 -43.68 87.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.02 0.438 . . . . 0.0 110.421 -178.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -60.32 -49.22 78.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.269 -178.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.608 ' HA ' HD12 ' A' ' 14' ' ' ILE . 10.7 tp -59.16 -33.85 71.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.972 -179.092 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.37 -50.54 69.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.546 0.212 . . . . 0.0 110.875 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.01 -42.13 84.57 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.976 0.417 . . . . 0.0 110.441 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.608 HD12 ' HA ' ' A' ' 11' ' ' LEU . 94.8 mt -54.22 -52.92 33.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.7 178.33 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -51.54 -25.13 6.15 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -178.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.5 tptp -57.84 -35.52 71.02 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.603 0.24 . . . . 0.0 111.469 -178.032 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.3 mm -103.92 -47.88 10.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.119 0.485 . . . . 0.0 109.792 -178.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -117.57 79.18 12.16 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.043 -176.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -54.72 -20.59 22.31 Favored 'Trans proline' 0 N--CA 1.498 1.746 0 C-N-CA 121.545 1.497 . . . . 0.0 113.695 -175.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 19.5 p90 -90.41 5.45 47.45 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -174.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -80.72 125.12 29.65 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 173.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.581 ' O ' HD21 ' A' ' 11' ' ' LEU . 79.7 tttt -104.59 -39.51 6.35 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.814 -0.354 . . . . 0.0 111.124 -172.781 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -134.41 146.33 49.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.956 0.408 . . . . 0.0 111.27 -175.579 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.444 HD11 HD12 ' A' ' 14' ' ' ILE . 21.1 mt -100.87 133.65 43.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 172.024 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.7 t -92.39 -47.19 14.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.936 179.21 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.516 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -152.07 154.18 35.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.068 178.777 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.4 p -141.82 132.02 24.87 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.01 0.433 . . . . 0.0 110.748 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.7 t -107.4 128.98 54.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.737 176.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 87.3 p -54.58 -37.87 66.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.302 -172.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -152.74 127.34 9.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.231 0.539 . . . . 0.0 111.702 -178.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.402 HG21 ' HB3' ' A' ' 52' ' ' PHE . 97.5 t -145.27 141.82 22.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 114.97 -1.014 . . . . 0.0 109.521 -177.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.92 149.9 51.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.041 -178.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.514 ' HD1' HG21 ' A' ' 46' ' ' THR . 27.1 t80 -100.72 131.64 46.51 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.278 0.561 . . . . 0.0 111.597 -177.005 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -126.5 144.73 50.77 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.826 179.339 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 84.2 m -122.71 147.94 45.89 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 177.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -108.84 132.0 54.44 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.983 0.421 . . . . 0.0 110.379 176.192 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.9 t-20 -104.1 114.76 29.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.779 177.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.9 m -67.7 -32.71 73.54 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.969 -176.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.0 t -60.37 -39.71 88.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.757 0.313 . . . . 0.0 110.904 -177.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -94.09 -21.41 19.14 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 69.37 43.97 0.99 Allowed 'General case' 0 C--O 1.232 0.139 0 CA-C-O 121.419 0.628 . . . . 0.0 109.703 -177.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -150.02 163.46 38.08 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.165 -177.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -96.43 139.77 32.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.25 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -123.69 130.28 52.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.083 176.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -75.27 142.48 43.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.0 178.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.514 HG21 ' HD1' ' A' ' 33' ' ' PHE . 72.9 p -92.33 177.21 6.21 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.719 -0.393 . . . . 0.0 110.07 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -86.93 13.6 8.79 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.4 t -109.48 106.39 20.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 120.928 0.394 . . . . 0.0 110.619 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -129.95 111.55 12.65 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 173.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.64 176.51 38.95 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 120.261 -0.971 . . . . 0.0 112.256 -168.302 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.473 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.53 136.72 37.63 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 175.201 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.402 ' HB3' HG21 ' A' ' 31' ' ' VAL . 4.3 t80 -101.64 126.16 48.43 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.27 -175.637 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.473 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 5.8 m-85 -129.88 142.25 50.69 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.817 0.341 . . . . 0.0 110.402 177.055 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.655 HD11 HG23 ' A' ' 116' ' ' ILE . 67.5 mt -101.61 127.02 55.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 172.188 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.593 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.1 m-30 -108.55 139.66 43.01 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.929 0.395 . . . . 0.0 111.516 -176.032 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -113.13 143.34 44.52 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.014 174.013 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 30.0 ttp180 -141.13 152.86 45.06 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.59 178.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -86.89 28.11 0.93 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.164 -178.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -155.3 152.35 29.1 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -63.98 133.78 95.71 Favored Pre-proline 0 CA--C 1.541 0.598 0 CA-C-O 118.49 -0.767 . . . . 0.0 110.252 -176.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -68.35 140.91 58.55 Favored 'Cis proline' 0 N--CA 1.499 1.797 0 CA-C-N 121.702 1.644 . . . . 0.0 111.437 -1.079 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -63.64 -38.72 92.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.189 -177.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -141.06 141.85 34.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.611 0.719 . . . . 0.0 111.086 -176.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.2 t -149.54 152.16 35.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.922 -178.314 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.465 HG13 HD11 ' A' ' 80' ' ' ILE . 54.0 mt -113.03 138.66 41.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 -177.055 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -131.79 142.09 49.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.146 -177.705 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.1 mt -121.11 130.55 74.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-O 121.275 0.559 . . . . 0.0 109.815 172.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -96.44 99.58 11.23 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.269 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.7 t-20 -72.16 107.12 4.66 Favored 'General case' 0 C--N 1.332 -0.176 0 O-C-N 123.58 0.55 . . . . 0.0 111.192 -174.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.6 mtm105 -74.51 -39.8 62.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.387 -171.25 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 56.7 mt -74.2 -45.17 50.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.475 -175.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 39.4 t-20 -95.05 -3.23 48.63 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -175.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 63.3 p 51.52 42.54 29.53 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.479 0.656 . . . . 0.0 110.959 178.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.6 m -124.37 148.92 47.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.201 -179.315 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 11.2 p -98.97 134.7 41.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.281 -178.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -131.39 122.15 25.83 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.33 175.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.5 p -125.58 149.76 30.49 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.008 -178.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -149.04 132.13 8.18 Favored Pre-proline 0 CA--C 1.538 0.511 0 CA-C-O 118.834 -0.603 . . . . 0.0 110.493 175.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.45 150.92 36.96 Favored 'Trans proline' 0 N--CA 1.499 1.816 0 C-N-CA 121.552 1.501 . . . . 0.0 112.276 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.465 HD11 HG13 ' A' ' 65' ' ' ILE . 66.1 mt -90.81 123.39 42.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.143 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.393 178.231 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 80.6 p -98.79 163.27 12.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.993 176.041 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -97.82 15.88 61.13 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 120.861 -0.685 . . . . 0.0 113.265 -178.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 40.7 p -111.0 2.1 17.82 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 117.746 0.773 . . . . 0.0 112.956 176.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.3 mt -69.49 141.07 54.01 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 118.077 0.399 . . . . 0.0 111.192 -177.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -113.99 135.8 53.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.739 175.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 67.2 mt -119.38 158.34 26.35 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.986 0.422 . . . . 0.0 111.121 -175.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -149.68 141.53 23.73 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 176.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.0 t -105.69 109.17 21.04 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.196 -178.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -106.77 103.66 47.98 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 118.306 -0.854 . . . . 0.0 108.757 170.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.73 143.75 62.95 Favored 'Trans proline' 0 N--CA 1.499 1.81 0 CA-C-N 120.6 1.25 . . . . 0.0 111.955 -171.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -90.72 14.46 50.44 Favored 'Cis proline' 0 N--CA 1.501 1.916 0 CA-C-N 121.016 1.398 . . . . 0.0 113.518 -3.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -94.55 161.87 14.03 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 122.36 0.264 . . . . 0.0 110.411 -178.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 46.9 tp -114.93 132.89 56.4 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 172.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.479 HD11 ' CG2' ' A' ' 102' ' ' ILE . 8.6 tp -122.73 139.42 53.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.282 -173.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 48.7 p90 -142.93 154.62 44.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.826 0.346 . . . . 0.0 110.488 175.313 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.2 mtm180 -101.78 145.76 28.71 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.7 -178.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -127.68 164.77 21.35 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.659 0.743 . . . . 0.0 111.534 -176.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -47.2 145.62 2.2 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.171 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 12.4 tpt180 65.28 30.91 10.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.322 -0.854 . . . . 0.0 112.019 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.0 t 64.93 35.27 8.41 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.896 0.379 . . . . 0.0 111.527 166.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 50.6 mtm180 -98.25 150.63 21.32 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 179.09 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.597 HD13 ' CH2' ' B' 1345 ' ' TRP . 74.2 mt -114.66 127.53 72.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 -178.247 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -140.14 150.39 44.19 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.612 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.7 169.32 26.08 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 120.965 -0.636 . . . . 0.0 111.634 -175.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -125.22 137.3 54.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.389 -0.405 . . . . 0.0 110.4 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 42.7 t90 -107.18 127.53 53.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.6 176.188 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -114.54 146.15 41.09 Favored 'General case' 0 C--N 1.329 -0.294 0 O-C-N 123.223 0.327 . . . . 0.0 110.509 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -51.57 -36.35 44.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.627 177.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -134.08 134.85 42.79 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.416 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.7 t -61.2 -41.81 97.48 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.988 -177.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -59.88 -43.02 94.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.359 0.599 . . . . 0.0 110.176 179.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -56.98 -44.54 82.76 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.937 178.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 43.3 t -59.98 -38.71 83.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.698 177.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -59.1 -46.05 89.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.876 0.369 . . . . 0.0 110.502 -177.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 60.6 ttm-85 -59.79 -48.71 80.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.053 0.454 . . . . 0.0 110.579 -178.043 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.655 HG23 HD11 ' A' ' 54' ' ' ILE . 30.1 mm -58.33 -44.56 88.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.052 -179.002 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 53.3 p -59.4 -44.2 92.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.649 -177.297 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.78 -44.59 94.14 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 -178.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.516 HD13 ' HB2' ' A' ' 26' ' ' ASP . 10.4 mt -58.73 -48.34 81.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.114 0.483 . . . . 0.0 110.553 -178.507 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 50.6 t -58.9 -43.41 88.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.078 -178.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -57.4 -42.43 82.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.636 -178.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.33 -45.3 96.73 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.954 -0.858 . . . . 0.0 110.954 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.6 mt -57.82 -42.69 84.79 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.93 0.395 . . . . 0.0 110.524 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 86.9 mt -59.39 -41.73 90.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.636 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 15.0 pttm -95.5 11.22 33.74 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 67.5 m -119.95 145.73 46.48 Favored 'General case' 0 C--O 1.232 0.144 0 O-C-N 122.141 -0.349 . . . . 0.0 110.39 179.035 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 85.3 tttt . . . . . 0 C--O 1.219 -0.51 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.686 -179.645 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.364 0 N-CA-C 110.653 -0.979 . . . . 0.0 110.653 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -64.07 144.56 87.7 Favored 'Trans proline' 0 N--CA 1.496 1.648 0 CA-C-N 119.303 1.552 . . . . 0.0 111.906 -175.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -124.14 153.96 40.75 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.503 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -74.18 159.08 84.68 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.571 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -70.01 86.43 0.62 Allowed 'Trans proline' 0 N--CA 1.495 1.567 0 C-N-CA 121.24 1.293 . . . . 0.0 111.952 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 77.8 mt -62.74 -37.59 87.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.163 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 27.6 tp -75.9 132.55 40.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.872 0.368 . . . . 0.0 110.771 -178.41 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -115.3 151.8 33.9 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.229 178.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -60.58 -46.5 89.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.891 -178.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -148.98 160.26 43.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.666 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 93.0 mtm-85 -113.15 133.88 54.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.35 179.054 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.57 162.59 19.42 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.611 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -49.66 144.09 20.55 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 121.268 1.312 . . . . 0.0 112.015 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 53.2 m-85 -116.61 99.82 53.05 Favored Pre-proline 0 C--O 1.235 0.293 0 CA-C-O 119.125 -0.464 . . . . 0.0 110.53 -179.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -60.39 128.96 27.79 Favored 'Trans proline' 0 N--CA 1.496 1.657 0 C-N-CA 121.0 1.133 . . . . 0.0 111.355 178.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 99.79 -5.06 58.04 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 121.098 -0.572 . . . . 0.0 113.353 -178.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -52.05 143.49 13.86 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 118.252 1.026 . . . . 0.0 111.35 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 4.6 ttt -61.07 132.73 92.4 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-O 118.704 -0.665 . . . . 0.0 110.276 -178.161 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.93 160.95 44.84 Favored 'Trans proline' 0 N--CA 1.495 1.615 0 C-N-CA 121.234 1.289 . . . . 0.0 111.523 174.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -96.07 110.21 22.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.81 -179.296 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 16.8 mt -62.57 154.72 72.3 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.147 178.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -79.03 139.86 15.47 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 C-N-CA 121.227 1.285 . . . . 0.0 110.841 173.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -95.66 125.72 48.13 Favored Pre-proline 0 CA--C 1.534 0.354 0 CA-C-O 118.803 -0.618 . . . . 0.0 109.667 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -77.95 154.03 29.43 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 121.446 1.431 . . . . 0.0 111.643 173.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -58.47 154.2 43.27 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 121.313 1.342 . . . . 0.0 111.404 177.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1343 ' ' LEU . . . . . 0.532 ' H ' HD12 ' B' 1343 ' ' LEU . 6.2 mp -50.66 -30.5 13.73 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -176.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -55.88 -38.04 69.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.82 0.343 . . . . 0.0 111.188 -177.21 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1345 ' ' TRP . . . . . 0.597 ' CH2' HD13 ' A' ' 102' ' ' ILE . 7.6 t90 -61.92 -48.06 82.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.151 -177.353 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -60.4 -47.06 87.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.113 0.483 . . . . 0.0 110.519 -177.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -59.93 -45.38 92.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.794 -177.474 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -57.81 -45.15 86.53 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.539 -177.143 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.21 -48.26 82.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.577 -178.208 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -57.76 -42.01 83.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.951 -177.223 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -64.01 -48.42 76.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.022 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -55.18 -45.75 75.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.077 -178.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 42.1 tp10 -65.03 -37.01 86.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.005 179.411 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -158.0 146.12 18.75 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.763 0.316 . . . . 0.0 110.612 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 31.1 tp . . . . . 0 C--O 1.219 -0.509 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.482 179.68 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -67.88 153.8 74.56 Favored 'Trans proline' 0 N--CA 1.495 1.564 0 C-N-CA 121.28 1.32 . . . . 0.0 112.008 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -55.92 -39.85 72.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.934 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 45.0 ttm -82.82 123.35 29.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.625 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -146.51 154.23 41.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.465 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 18.5 p30 -76.2 153.97 35.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.709 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 29.5 tp -69.29 -39.43 78.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.838 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.4 mtp -64.73 116.49 6.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.621 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -174.56 125.44 0.3 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.557 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -78.94 85.64 4.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.556 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -67.11 -33.35 75.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.596 -179.28 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 24.8 m -56.5 -41.07 76.06 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.919 0.39 . . . . 0.0 110.759 -176.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.7 mm -60.66 -46.44 95.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.287 -178.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.5 m -59.12 -43.93 91.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.519 -177.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -59.64 -45.89 90.64 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.607 -178.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 66.0 mtt -58.26 -43.68 88.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.027 0.442 . . . . 0.0 110.347 -178.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -60.34 -48.56 81.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.35 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.642 ' HA ' HD12 ' A' ' 14' ' ' ILE . 9.4 tp -60.79 -33.6 73.23 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.051 -178.546 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.59 -49.57 74.74 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.647 0.261 . . . . 0.0 110.673 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.99 -41.97 88.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.015 0.436 . . . . 0.0 110.501 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.664 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 92.9 mt -54.22 -53.01 32.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.535 178.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -53.47 -21.75 6.77 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -58.26 -34.85 70.94 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.584 0.23 . . . . 0.0 111.542 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.747 HG21 ' CB ' ' A' ' 75' ' ' SER . 46.6 mm -113.05 -37.77 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 120.679 0.276 . . . . 0.0 110.815 -176.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.5 t0 -116.7 77.4 8.25 Favored Pre-proline 0 CA--C 1.536 0.416 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.469 -177.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -54.85 -20.41 22.39 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 121.505 1.47 . . . . 0.0 113.416 -177.18 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 44.9 p90 -92.8 15.9 13.63 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -174.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -89.68 124.69 34.82 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 173.505 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.9 mmtp -97.54 -40.52 8.6 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.827 -175.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -153.09 157.52 40.53 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.574 -0.45 . . . . 0.0 111.503 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 46.7 mt -95.36 138.45 21.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.068 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.5 t -91.4 -46.42 14.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.801 176.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.516 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.0 t0 -154.72 156.56 36.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.006 178.768 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.7 p -143.11 132.65 23.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.016 0.436 . . . . 0.0 110.986 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.7 t -108.79 128.08 54.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.869 177.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.3 m -54.62 -39.06 67.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.226 -172.031 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -151.53 126.61 9.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.223 0.535 . . . . 0.0 111.742 -178.323 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.43 HG21 ' HB3' ' A' ' 52' ' ' PHE . 97.5 t -145.19 140.38 22.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.472 -177.718 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.52 149.85 50.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.068 -178.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.472 ' HD2' HG21 ' A' ' 46' ' ' THR . 21.7 t80 -101.45 130.14 47.63 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.289 0.566 . . . . 0.0 111.649 -176.178 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.432 ' CD2' HD11 ' B' 1338 ' ' LEU . 44.4 m-85 -124.91 142.46 51.45 Favored 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.687 178.612 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 72.1 m -122.07 147.47 46.07 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 177.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -104.79 131.94 51.64 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.018 0.437 . . . . 0.0 110.268 175.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -104.44 116.45 32.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.885 178.01 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 86.4 p -68.47 -31.62 71.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.966 -177.183 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -62.79 -38.34 90.29 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.986 -177.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -93.89 -21.48 19.21 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.9 t30 69.08 42.48 1.25 Allowed 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.246 0.546 . . . . 0.0 109.948 -178.019 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -153.12 166.38 32.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.124 -177.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -90.78 142.01 28.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.236 177.049 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -125.06 127.53 47.08 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 176.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -72.39 139.79 48.02 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 177.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.472 HG21 ' HD2' ' A' ' 33' ' ' PHE . 68.6 p -92.19 178.62 5.8 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.035 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -89.01 16.12 7.54 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.0 t -112.29 106.4 20.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-O 120.946 0.403 . . . . 0.0 110.557 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -129.75 111.25 12.46 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 173.173 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.67 176.61 38.97 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 120.112 -1.042 . . . . 0.0 112.157 -168.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.454 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.33 137.0 37.83 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 175.181 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.43 ' HB3' HG21 ' A' ' 31' ' ' VAL . 5.4 t80 -100.06 127.69 46.25 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.219 -176.511 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.454 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 7.1 m-85 -130.78 142.9 50.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.653 0.263 . . . . 0.0 110.319 177.22 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.688 HD11 HG23 ' A' ' 116' ' ' ILE . 67.4 mt -101.5 127.77 54.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 172.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.664 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.2 m-30 -108.48 137.32 46.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.939 0.4 . . . . 0.0 111.262 -175.369 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -117.58 143.34 46.21 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.143 176.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 51.4 ttt85 -139.85 147.53 40.81 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.8 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -86.91 28.14 0.93 Allowed 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.6 157.74 32.54 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.14 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -63.88 135.27 96.22 Favored Pre-proline 0 CA--C 1.539 0.553 0 CA-C-O 118.571 -0.728 . . . . 0.0 110.208 -176.29 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -66.71 140.86 51.98 Favored 'Cis proline' 0 N--CA 1.5 1.869 0 CA-C-N 121.66 1.629 . . . . 0.0 111.275 -3.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -68.14 -42.9 79.45 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.163 -176.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.431 ' CD2' HD22 ' A' ' 123' ' ' LEU . 74.6 m80 -143.03 140.58 31.04 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.622 0.725 . . . . 0.0 111.057 -176.389 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.8 t -150.08 152.31 34.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.056 -177.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 46.3 mt -111.48 137.71 42.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -178.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -131.83 142.03 49.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.042 -176.284 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.0 mt -123.44 133.75 68.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.195 0.521 . . . . 0.0 109.872 172.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -101.45 99.93 10.32 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.556 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -72.62 109.0 5.95 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 123.655 0.597 . . . . 0.0 111.037 -175.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -74.4 -40.39 62.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.2 -171.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 54.7 mt -71.19 -45.0 64.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.613 -175.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 53.2 m-20 -95.1 -3.13 48.64 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -175.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.3 p 51.17 42.2 28.51 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.439 0.638 . . . . 0.0 111.092 178.249 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 42.9 m -127.96 149.07 50.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.153 -0.93 . . . . 0.0 109.729 179.164 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.747 ' CB ' HG21 ' A' ' 17' ' ' ILE . 49.0 p -102.28 144.99 30.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.923 0.392 . . . . 0.0 111.161 -177.419 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -138.38 122.16 17.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.301 177.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 p -125.43 148.38 29.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.53 -0.304 . . . . 0.0 111.061 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -146.44 136.46 11.96 Favored Pre-proline 0 CA--C 1.537 0.48 0 CA-C-O 118.992 -0.528 . . . . 0.0 110.507 175.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.4 150.92 37.14 Favored 'Trans proline' 0 N--CA 1.498 1.771 0 C-N-CA 121.615 1.544 . . . . 0.0 112.484 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 71.3 mt -90.51 137.26 21.97 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-O 120.916 0.389 . . . . 0.0 110.317 177.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.9 p -132.18 155.39 48.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.708 177.075 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.555 ' HA2' HD22 ' A' ' 124' ' ' LEU . . . -96.45 32.0 6.92 Favored Glycine 0 CA--C 1.527 0.789 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.331 -178.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 63.4 p -100.85 -26.01 13.91 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 173.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.9 mt -69.01 147.35 51.72 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 120.889 0.375 . . . . 0.0 111.317 -176.138 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -116.2 135.84 53.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.638 175.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.3 mt -109.18 159.64 16.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.208 -174.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -148.9 141.36 24.26 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 178.499 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.8 t -98.82 109.21 22.0 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.725 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -106.85 103.61 48.0 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 172.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -71.32 139.65 35.39 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 CA-C-N 120.613 1.255 . . . . 0.0 112.012 -171.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -89.36 9.48 64.28 Favored 'Cis proline' 0 N--CA 1.5 1.897 0 CA-C-N 121.267 1.488 . . . . 0.0 113.737 -3.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -84.99 170.72 12.74 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.72 0.295 . . . . 0.0 110.858 -177.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 61.8 tp -118.75 132.75 56.15 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 170.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.8 tp -124.16 140.06 53.33 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.538 0.208 . . . . 0.0 110.583 -173.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 20.5 p90 -145.72 149.89 35.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.851 0.358 . . . . 0.0 110.562 175.521 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 54.5 mtm180 -106.71 148.17 28.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 -177.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -129.56 165.02 22.55 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.837 0.827 . . . . 0.0 111.433 -176.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -47.92 148.15 1.77 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.219 -177.244 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 54.7 ttt180 65.33 30.8 10.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.019 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 31.8 m 65.19 35.24 7.93 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.795 0.331 . . . . 0.0 111.575 165.376 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -99.74 145.95 27.09 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.45 HG21 ' CH2' ' B' 1345 ' ' TRP . 85.2 mt -113.7 130.36 67.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.114 0.483 . . . . 0.0 109.81 -178.517 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -137.91 147.71 44.65 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.433 177.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.91 168.16 25.73 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 111.373 -0.691 . . . . 0.0 111.373 -176.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -125.2 140.41 52.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.803 0.335 . . . . 0.0 110.803 -179.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 21.9 t90 -106.89 123.82 48.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.584 175.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -113.33 141.55 46.89 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.824 0.345 . . . . 0.0 110.519 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -51.31 -35.82 39.64 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.672 178.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 -135.57 135.98 40.74 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.33 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 82.7 p -63.39 -40.23 96.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.144 -177.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -60.65 -43.3 97.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.356 0.598 . . . . 0.0 110.096 178.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -56.73 -45.8 81.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.563 0.697 . . . . 0.0 109.928 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 47.7 t -60.09 -38.13 82.01 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.811 178.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -59.48 -46.6 88.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.863 0.363 . . . . 0.0 110.514 -177.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 72.2 mtm180 -60.07 -48.16 82.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.008 0.433 . . . . 0.0 110.646 -177.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.688 HG23 HD11 ' A' ' 54' ' ' ILE . 28.9 mm -58.42 -44.94 89.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.072 -178.803 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.2 p -59.31 -44.3 92.57 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.679 -177.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.48 -44.42 93.71 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -178.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.516 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.3 mt -58.59 -48.41 81.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.185 0.517 . . . . 0.0 110.471 -178.601 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.508 HG12 HD11 ' A' ' 124' ' ' LEU . 54.3 t -58.63 -43.52 87.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.185 -178.389 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.8 m120 -58.2 -42.66 86.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.745 -178.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.97 -42.94 99.77 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.409 -0.676 . . . . 0.0 111.409 -178.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.431 HD22 ' CD2' ' A' ' 63' ' ' HIS . 50.1 mt -64.1 -43.27 95.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.759 0.314 . . . . 0.0 111.303 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.555 HD22 ' HA2' ' A' ' 82' ' ' GLY . 24.0 mt -63.74 -45.01 91.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.385 -176.349 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -70.81 -38.18 73.28 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.826 -0.35 . . . . 0.0 111.168 -177.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 67.7 p -88.28 158.58 18.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.54 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt . . . . . 0 C--O 1.221 -0.438 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.571 179.922 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.299 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -50.71 141.74 34.03 Favored 'Trans proline' 0 N--CA 1.494 1.554 0 CA-C-N 118.802 1.301 . . . . 0.0 112.031 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -111.51 148.7 32.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.5 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -67.69 153.45 95.04 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.514 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -75.82 130.34 12.38 Favored 'Trans proline' 0 N--CA 1.494 1.554 0 C-N-CA 121.253 1.302 . . . . 0.0 112.072 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 79.7 mt -63.33 -40.24 96.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.709 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1324 ' ' LEU . . . . . 0.51 ' N ' HD12 ' B' 1324 ' ' LEU . 6.8 mp -102.41 137.42 40.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.515 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -100.05 125.61 46.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.566 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.07 -40.07 84.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.828 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -95.23 137.56 34.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.561 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 25.8 mmt180 -103.62 132.51 49.81 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.399 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.57 164.48 14.64 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.491 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -49.26 151.9 6.01 Favored 'Trans proline' 0 N--CA 1.495 1.577 0 C-N-CA 121.326 1.351 . . . . 0.0 112.094 179.307 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -107.39 99.88 30.57 Favored Pre-proline 0 CA--C 1.534 0.345 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.516 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -57.91 128.97 31.03 Favored 'Trans proline' 0 N--CA 1.496 1.636 0 C-N-CA 121.054 1.169 . . . . 0.0 111.674 178.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 76.74 19.9 77.14 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.91 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -53.72 141.63 25.94 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 117.883 0.842 . . . . 0.0 111.087 177.274 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 8.3 ttt -65.93 118.06 48.36 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-O 118.703 -0.665 . . . . 0.0 110.574 -178.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -65.09 156.97 59.86 Favored 'Trans proline' 0 N--CA 1.498 1.74 0 C-N-CA 121.121 1.214 . . . . 0.0 111.397 172.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 38.9 t30 -97.36 110.59 23.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.932 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1338 ' ' LEU . . . . . 0.432 HD11 ' CD2' ' A' ' 34' ' ' TYR . 11.6 mt -66.12 152.1 94.43 Favored Pre-proline 0 C--N 1.33 -0.26 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 177.538 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.1 139.61 15.18 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 121.083 1.189 . . . . 0.0 111.084 174.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -97.14 125.9 44.14 Favored Pre-proline 0 CA--C 1.535 0.396 0 CA-C-O 118.442 -0.789 . . . . 0.0 110.007 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -78.17 168.97 21.02 Favored 'Trans proline' 0 N--CA 1.496 1.643 0 C-N-CA 121.315 1.343 . . . . 0.0 111.734 176.143 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.91 152.55 57.12 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 C-N-CA 121.268 1.312 . . . . 0.0 111.344 177.17 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1343 ' ' LEU . . . . . 0.534 ' H ' HD12 ' B' 1343 ' ' LEU . 6.1 mp -49.97 -25.23 3.12 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -176.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 84.9 m-85 -55.34 -37.65 67.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.742 0.306 . . . . 0.0 111.167 -176.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1345 ' ' TRP . . . . . 0.45 ' CH2' HG21 ' A' ' 102' ' ' ILE . 58.2 t90 -61.78 -48.1 82.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.406 -176.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -62.01 -49.55 75.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.981 0.42 . . . . 0.0 110.52 -176.477 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -60.9 -46.05 92.18 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.083 -175.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 42.4 tp10 -59.29 -46.85 87.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.72 -175.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -61.58 -50.75 71.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.891 -176.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -59.43 -42.03 90.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.373 -175.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 82.4 tttt -68.04 -49.75 59.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.519 -176.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -58.52 -49.0 78.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.59 -175.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -73.07 -37.07 66.94 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.923 -0.311 . . . . 0.0 111.351 -177.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -124.64 127.39 47.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.8 0.333 . . . . 0.0 110.748 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 78.1 mt . . . . . 0 C--O 1.221 -0.427 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.543 179.852 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.298 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -86.92 30.54 0.47 Allowed 'Trans proline' 0 N--CA 1.491 1.359 0 C-N-CA 121.636 1.557 . . . . 0.0 112.514 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -59.12 -41.32 87.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.759 0.314 . . . . 0.0 110.593 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 85.4 mtp -88.75 143.51 26.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.594 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -99.07 145.54 27.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.544 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 77.1 m-20 -67.62 143.24 56.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.561 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 78.5 mt -57.98 -40.03 79.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.767 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.8 mtp -86.38 134.13 33.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.496 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -87.78 117.99 27.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.571 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -83.46 154.4 23.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.438 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -59.82 -38.74 82.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.839 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.0 p -57.7 -41.63 82.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.975 0.417 . . . . 0.0 110.435 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.2 mm -59.75 -44.14 93.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.108 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 32.7 m -59.44 -45.18 92.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.534 -177.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -59.05 -45.96 89.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.369 -178.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.5 mtt -58.14 -43.92 87.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.188 0.518 . . . . 0.0 110.387 -177.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -59.95 -49.46 77.61 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.189 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.74 ' HA ' HD12 ' A' ' 14' ' ' ILE . 10.8 tp -58.79 -33.69 70.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.988 -178.678 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.05 -50.94 68.65 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.659 0.266 . . . . 0.0 110.891 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.85 -41.55 82.61 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.967 0.413 . . . . 0.0 110.5 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.74 HD12 ' HA ' ' A' ' 11' ' ' LEU . 88.8 mt -54.31 -52.93 34.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.627 178.439 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -51.43 -24.17 4.67 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt -58.56 -34.11 70.68 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 -177.034 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.697 HG21 ' CB ' ' A' ' 75' ' ' SER . 43.7 mm -110.22 -42.05 4.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.79 0.329 . . . . 0.0 110.239 -177.063 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -116.25 79.23 8.6 Favored Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.137 -178.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -53.86 -19.96 16.45 Favored 'Trans proline' 0 N--CA 1.497 1.717 0 C-N-CA 121.54 1.493 . . . . 0.0 113.498 -176.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.3 p90 -95.96 15.23 21.08 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -174.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -91.65 126.59 36.79 Favored 'General case' 0 C--N 1.333 -0.121 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 173.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.614 ' O ' HD21 ' A' ' 11' ' ' LEU . 27.6 ttmt -109.34 -38.0 5.6 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 120.835 -0.346 . . . . 0.0 111.37 -172.807 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -132.81 145.54 51.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.962 0.41 . . . . 0.0 111.157 -175.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.427 HD11 HD12 ' A' ' 14' ' ' ILE . 19.2 mt -100.45 133.44 43.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 171.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.1 t -90.57 -47.06 14.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.987 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.503 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.0 t0 -153.82 156.08 37.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.994 179.062 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.7 p -142.57 132.05 23.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.102 0.477 . . . . 0.0 110.917 179.44 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.0 t -108.52 127.37 53.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.731 177.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 86.9 p -54.78 -38.24 67.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.28 -172.258 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -151.19 126.36 9.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.215 0.531 . . . . 0.0 111.764 -178.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.422 HG21 ' HB3' ' A' ' 52' ' ' PHE . 97.3 t -145.28 140.12 22.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.32 -177.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -130.22 149.85 51.73 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.17 -177.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.514 ' CD2' HG21 ' A' ' 46' ' ' THR . 11.0 t80 -96.85 133.55 41.32 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.313 0.578 . . . . 0.0 111.638 -176.743 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -125.77 140.91 52.29 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.404 177.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 86.2 m -123.0 144.06 49.51 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 177.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -105.31 130.24 53.48 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.901 0.381 . . . . 0.0 110.155 175.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -101.56 115.52 30.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.785 176.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.5 m -67.48 -33.18 74.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.895 -177.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.3 m -61.54 -38.08 86.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.631 0.253 . . . . 0.0 111.021 -177.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -94.92 -21.37 18.69 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 22.5 t30 68.99 45.44 0.92 Allowed 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.519 0.676 . . . . 0.0 109.558 -177.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 74.5 tt0 -155.96 151.63 27.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.203 -177.074 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 88.8 m95 -84.32 142.46 30.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.123 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -125.02 131.49 53.38 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.01 -0.366 . . . . 0.0 110.01 176.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 55.8 pttt -74.87 136.79 41.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.277 178.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.514 HG21 ' CD2' ' A' ' 33' ' ' PHE . 72.4 p -92.31 168.46 11.3 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.775 -0.37 . . . . 0.0 110.285 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -74.22 -18.49 60.74 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.5 t -75.51 106.39 5.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-O 121.042 0.448 . . . . 0.0 110.457 -178.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -133.29 110.95 10.43 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 174.476 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.61 176.54 38.92 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 120.277 -0.963 . . . . 0.0 112.252 -168.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.462 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.39 135.48 37.45 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 174.662 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.422 ' HB3' HG21 ' A' ' 31' ' ' VAL . 5.3 t80 -99.12 127.48 45.08 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.134 -176.137 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.462 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 7.1 m-85 -130.72 142.4 50.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.297 177.271 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.674 HD11 HG23 ' A' ' 116' ' ' ILE . 66.5 mt -101.54 127.51 54.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 172.43 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.667 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.8 m-30 -108.47 136.22 48.46 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.994 0.426 . . . . 0.0 111.394 -175.27 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 79.0 t60 -112.05 143.34 43.22 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.247 174.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -142.01 146.58 35.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.041 178.213 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -86.89 28.04 0.94 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.267 -0.424 . . . . 0.0 112.081 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.6 169.53 24.21 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -64.02 125.29 87.67 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-O 118.441 -0.79 . . . . 0.0 110.018 -178.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -78.39 141.0 63.19 Favored 'Cis proline' 0 N--CA 1.497 1.677 0 CA-C-N 121.92 1.721 . . . . 0.0 111.831 -1.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -64.9 -41.5 95.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.993 -177.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -142.71 136.97 29.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.365 0.602 . . . . 0.0 110.935 -177.034 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.1 t -150.55 152.35 34.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.38 -178.037 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.419 HG13 HD11 ' A' ' 80' ' ' ILE . 43.0 mt -111.15 138.44 39.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 -178.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -131.88 142.0 49.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.955 -176.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 62.8 mt -123.5 132.76 70.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.255 0.55 . . . . 0.0 109.784 172.497 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -99.15 99.52 10.52 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.234 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 56.8 t-20 -76.56 107.82 9.1 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 121.748 0.785 . . . . 0.0 110.86 -174.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 60.7 ttm-85 -73.41 -35.98 65.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.516 -170.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.6 mt -71.47 -45.35 62.78 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.999 -173.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 42.1 p-10 -95.2 -3.35 47.9 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -177.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.7 m 58.32 44.25 18.8 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.497 0.665 . . . . 0.0 109.97 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 29.3 m -134.35 149.06 50.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.224 -177.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.697 ' CB ' HG21 ' A' ' 17' ' ' ILE . 10.8 p -101.85 144.99 29.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.283 -177.596 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -137.31 122.24 18.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.444 177.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 13.0 p -125.42 149.22 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-O 120.933 0.397 . . . . 0.0 111.177 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -147.83 131.35 8.26 Favored Pre-proline 0 CA--C 1.538 0.513 0 CA-C-O 118.747 -0.644 . . . . 0.0 110.241 176.329 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -75.35 150.84 37.25 Favored 'Trans proline' 0 N--CA 1.5 1.872 0 C-N-CA 121.475 1.45 . . . . 0.0 112.432 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.419 HD11 HG13 ' A' ' 65' ' ' ILE . 62.5 mt -90.69 123.01 42.67 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-O 120.846 0.355 . . . . 0.0 110.488 179.276 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 73.0 p -99.66 154.61 18.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.869 174.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -92.69 24.14 25.1 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.868 -179.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 38.8 p -111.03 -9.91 14.38 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 175.19 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.9 mt -67.74 140.39 56.72 Favored 'General case' 0 C--O 1.232 0.142 0 O-C-N 122.112 -0.367 . . . . 0.0 111.275 -176.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.9 tt0 -113.48 135.81 53.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.853 176.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 61.3 mt -113.61 161.31 17.59 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.75 -176.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -149.99 143.71 25.37 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.3 t -99.69 109.25 21.73 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.515 179.094 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -106.75 103.75 48.29 Favored Pre-proline 0 C--N 1.329 -0.321 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 173.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -67.92 140.1 49.36 Favored 'Trans proline' 0 N--CA 1.496 1.647 0 CA-C-N 120.403 1.179 . . . . 0.0 111.784 -172.162 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -89.76 9.24 64.61 Favored 'Cis proline' 0 N--CA 1.5 1.899 0 CA-C-N 121.239 1.478 . . . . 0.0 113.699 -5.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -89.58 172.79 8.71 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.607 0.241 . . . . 0.0 110.815 -176.05 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.8 tp -115.95 136.38 53.1 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 172.199 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 11.6 tp -129.5 140.64 51.2 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.617 0.246 . . . . 0.0 110.654 -174.336 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -146.39 157.32 43.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.808 0.337 . . . . 0.0 110.418 175.22 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.4 mtm105 -101.88 144.79 30.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.629 -177.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -127.49 163.02 25.03 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.951 0.881 . . . . 0.0 111.854 -176.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -47.77 149.98 1.16 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.36 -0.837 . . . . 0.0 112.177 -177.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 93.0 mtt180 62.21 30.8 17.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.158 -0.928 . . . . 0.0 112.102 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 69.6 m 65.74 35.23 6.97 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.866 0.365 . . . . 0.0 111.487 165.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 68.1 mtp180 -101.23 151.37 21.94 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 78.5 mt -111.37 126.75 68.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 -178.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 32.9 mtp180 -130.82 145.35 51.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.658 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -140.84 167.98 25.44 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -127.96 141.71 51.45 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.952 0.406 . . . . 0.0 110.882 -178.343 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 70.8 t90 -106.72 124.67 49.95 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.518 175.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -114.01 140.43 48.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.677 0.275 . . . . 0.0 110.512 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 68.9 t80 -51.7 -36.72 47.84 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.665 178.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 37.3 t-20 -134.46 135.66 42.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.438 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.3 m -61.22 -42.05 97.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.07 -177.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -59.85 -43.4 94.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.399 0.619 . . . . 0.0 110.136 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -56.78 -44.87 82.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.49 0.662 . . . . 0.0 110.079 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 45.9 t -59.7 -39.83 85.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.673 178.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -58.79 -44.86 90.83 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.848 0.356 . . . . 0.0 110.669 -177.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -60.79 -49.79 76.07 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.73 -177.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.674 HG23 HD11 ' A' ' 54' ' ' ILE . 32.9 mm -58.47 -44.57 89.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.051 0.453 . . . . 0.0 109.982 -178.493 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 60.1 p -59.79 -44.16 94.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.677 -177.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.66 -43.69 94.28 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.67 -0.972 . . . . 0.0 110.67 -178.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.503 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.1 mt -59.18 -49.01 79.49 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.118 0.485 . . . . 0.0 110.617 -178.308 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 53.8 t -58.9 -43.51 88.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.083 -178.398 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -58.03 -42.52 85.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.865 0.364 . . . . 0.0 110.674 -178.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.97 -41.47 99.66 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 -179.058 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 36.3 mt -62.5 -43.16 99.5 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.878 0.371 . . . . 0.0 111.119 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 79.9 mt -64.14 -44.89 90.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.618 -176.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 49.4 pttt -70.84 -36.97 73.11 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.301 -177.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 55.0 p -62.44 162.88 9.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.776 0.322 . . . . 0.0 110.514 -179.765 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 99.3 mttt . . . . . 0 C--O 1.221 -0.442 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.5 -179.802 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.29 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.59 141.93 56.99 Favored 'Trans proline' 0 N--CA 1.495 1.612 0 C-N-CA 121.33 1.353 . . . . 0.0 111.883 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -118.34 151.14 38.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.46 -179.609 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -68.36 158.22 85.39 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.493 179.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -61.93 -32.25 84.76 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 121.268 1.312 . . . . 0.0 112.058 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 78.7 mt -58.91 -41.84 88.19 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.538 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.0 mt -65.98 -38.81 89.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.044 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -56.82 -40.51 76.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.874 -179.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -64.27 -46.11 85.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.876 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -144.99 147.32 32.51 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.719 -179.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 41.4 tpt85 -101.38 111.93 24.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.371 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.65 155.17 41.03 Favored Pre-proline 0 CA--C 1.532 0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.459 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -51.89 142.89 41.38 Favored 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 121.288 1.325 . . . . 0.0 111.854 179.122 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 4.3 t80 -72.22 114.31 28.32 Favored Pre-proline 0 CA--C 1.536 0.429 0 CA-C-O 118.796 -0.621 . . . . 0.0 110.132 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -57.94 129.87 35.44 Favored 'Trans proline' 0 N--CA 1.496 1.643 0 CA-C-N 120.383 1.172 . . . . 0.0 111.582 -178.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 105.06 -5.09 41.85 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-O 119.439 -0.645 . . . . 0.0 113.38 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -75.22 118.02 17.67 Favored 'General case' 0 C--O 1.23 0.078 0 CA-C-N 118.417 1.108 . . . . 0.0 110.209 174.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 8.5 ttt -93.06 118.09 67.71 Favored Pre-proline 0 CA--C 1.534 0.362 0 CA-C-O 118.662 -0.685 . . . . 0.0 110.525 -178.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.03 143.16 74.75 Favored 'Trans proline' 0 N--CA 1.497 1.692 0 C-N-CA 121.064 1.176 . . . . 0.0 111.487 173.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 42.5 t30 -97.66 108.76 21.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.712 -179.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 13.2 mt -79.76 145.92 63.38 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-O 119.04 -0.505 . . . . 0.0 109.762 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -79.19 139.93 15.25 Favored 'Trans proline' 0 N--CA 1.493 1.475 0 C-N-CA 121.178 1.252 . . . . 0.0 111.33 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 25.4 mmtp -97.16 125.69 44.87 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-O 118.85 -0.595 . . . . 0.0 109.798 178.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 9.4 Cg_exo -74.18 158.32 45.39 Favored 'Trans proline' 0 N--CA 1.497 1.732 0 C-N-CA 121.464 1.442 . . . . 0.0 112.11 172.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -53.63 157.11 10.3 Favored 'Trans proline' 0 N--CA 1.496 1.639 0 C-N-CA 121.381 1.387 . . . . 0.0 111.932 178.328 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 80.7 mt -49.98 -28.17 6.48 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -177.214 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -54.74 -37.58 66.09 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.922 0.391 . . . . 0.0 111.126 -177.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 41.9 t90 -60.85 -47.96 84.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.244 -178.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -59.93 -46.65 88.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.992 0.425 . . . . 0.0 110.307 -177.414 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -59.23 -45.97 89.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.661 -177.765 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -57.74 -44.71 86.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.573 -177.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.19 -47.56 85.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.673 -177.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -57.69 -42.91 84.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.828 -177.103 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 63.9 tttm -64.74 -48.15 75.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.188 -177.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -55.04 -46.53 75.31 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.244 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -64.91 -37.1 86.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.191 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -148.47 136.55 21.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.89 0.376 . . . . 0.0 110.794 -179.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 78.7 mt . . . . . 0 C--O 1.219 -0.501 0 CA-C-O 118.001 -0.999 . . . . 0.0 110.541 179.84 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.314 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.87 134.13 34.65 Favored 'Trans proline' 0 N--CA 1.495 1.601 0 CA-C-N 118.897 1.349 . . . . 0.0 112.072 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -82.13 -39.75 22.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.87 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 85.5 mtp -81.64 160.91 23.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.664 -179.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -58.89 150.75 23.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.653 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -79.45 102.16 8.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.645 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 78.5 mt -77.16 -40.09 46.68 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.836 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.0 mtp -102.54 160.32 14.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.674 -178.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.33 146.58 43.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.62 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -98.09 168.28 10.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.595 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -60.07 -36.84 78.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.066 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.4 m -57.0 -41.16 77.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.924 0.393 . . . . 0.0 110.498 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.3 mm -59.64 -44.76 94.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.088 -179.378 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.4 m -59.25 -45.2 91.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.986 0.422 . . . . 0.0 110.481 -177.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.0 mmt180 -58.99 -45.72 89.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.468 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.8 mtt -58.26 -43.79 88.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.121 0.486 . . . . 0.0 110.44 -178.116 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -59.28 -48.37 81.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.21 -178.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.651 ' HA ' HD12 ' A' ' 14' ' ' ILE . 9.4 tp -60.36 -33.39 72.36 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.146 -179.274 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.91 -49.77 74.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.677 0.275 . . . . 0.0 110.662 179.273 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.06 -41.95 89.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.974 0.416 . . . . 0.0 110.434 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.658 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 93.5 mt -54.28 -52.85 34.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.627 178.349 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -51.85 -27.29 12.13 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -177.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -58.94 -32.81 69.93 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -177.248 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.1 mm -106.17 -44.95 8.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.026 0.441 . . . . 0.0 110.064 -177.462 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -117.12 79.16 10.56 Favored Pre-proline 0 CA--C 1.535 0.4 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.276 -177.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -54.32 -20.22 19.29 Favored 'Trans proline' 0 N--CA 1.497 1.721 0 C-N-CA 121.473 1.449 . . . . 0.0 113.561 -175.318 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 14.5 p90 -93.52 15.13 16.74 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -174.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -81.28 128.12 33.46 Favored 'General case' 0 C--N 1.334 -0.1 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 173.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -97.51 -40.36 8.7 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.704 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -159.03 159.88 35.22 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.679 -0.409 . . . . 0.0 111.408 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 39.8 mt -96.22 138.39 21.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.052 178.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.9 t -90.87 -47.21 14.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.856 176.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.497 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.0 t0 -154.0 158.13 40.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.933 178.618 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 18.6 p -143.89 133.24 23.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.971 0.415 . . . . 0.0 111.153 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.3 t -110.12 127.8 55.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.74 177.204 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.4 m -54.86 -39.75 68.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.206 -171.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -149.81 125.91 10.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.262 0.553 . . . . 0.0 111.818 -178.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.442 HG21 ' HB3' ' A' ' 52' ' ' PHE . 97.2 t -145.19 142.25 22.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.447 -177.694 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.59 149.84 51.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.164 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -99.01 131.43 45.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.233 0.539 . . . . 0.0 111.519 -177.043 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -125.82 144.23 50.73 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.807 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 80.4 m -121.32 148.56 44.17 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -109.8 130.84 55.48 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.874 0.368 . . . . 0.0 110.452 176.135 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 36.9 t-20 -101.07 113.0 25.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.834 176.214 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.1 m -67.5 -32.73 73.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.976 -177.026 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.5 m -62.31 -38.52 89.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.666 0.269 . . . . 0.0 111.043 -177.187 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -94.72 -21.41 18.77 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -178.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 27.2 t30 68.74 45.76 0.99 Allowed 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.485 0.659 . . . . 0.0 109.356 -177.187 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -151.42 151.23 31.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.07 -176.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.42 ' CB ' HD12 ' B' 1338 ' ' LEU . 81.0 m95 -87.65 141.28 28.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.341 177.496 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -125.02 130.47 52.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.17 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -76.47 139.93 41.03 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.9 p -92.31 177.42 6.15 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.13 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.7 p30 -86.98 12.96 10.02 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.9 t -106.62 106.44 20.62 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-O 120.988 0.423 . . . . 0.0 110.377 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -130.1 112.55 13.53 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 174.422 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.56 38.96 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 120.157 -1.02 . . . . 0.0 112.148 -168.709 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.456 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -79.77 135.42 36.49 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 175.383 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.442 ' HB3' HG21 ' A' ' 31' ' ' VAL . 6.3 t80 -98.27 129.22 44.99 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.113 -176.63 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.456 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.6 m-85 -132.57 143.4 49.68 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.103 177.4 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.718 HD11 HG23 ' A' ' 116' ' ' ILE . 69.9 mt -101.57 128.12 54.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 172.609 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.658 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 13.4 m-30 -108.42 135.91 48.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.991 0.424 . . . . 0.0 111.247 -175.011 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 83.4 t60 -116.37 143.35 45.66 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.917 176.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -141.98 148.18 38.16 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.121 179.163 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -86.82 28.06 0.93 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 116.264 -0.426 . . . . 0.0 112.059 179.174 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.72 162.57 38.57 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.239 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 24.8 mp0 -64.06 130.7 94.67 Favored Pre-proline 0 CA--C 1.539 0.535 0 CA-C-O 118.517 -0.754 . . . . 0.0 110.031 -177.236 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.46 140.93 69.28 Favored 'Cis proline' 0 N--CA 1.498 1.739 0 CA-C-N 121.795 1.677 . . . . 0.0 111.63 -1.708 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -65.6 -42.69 91.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.04 -177.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.409 ' CD2' HD22 ' A' ' 123' ' ' LEU . 65.4 m80 -141.8 139.04 32.64 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.426 0.631 . . . . 0.0 110.917 -176.526 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.2 t -150.79 151.96 33.11 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.294 -178.334 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.7 mt -108.33 139.14 31.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -179.47 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.402 ' CD2' HG22 ' A' ' 77' ' ' VAL . 32.8 t80 -131.8 141.99 49.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.741 -176.591 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.0 mt -127.15 129.96 71.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-O 121.204 0.526 . . . . 0.0 110.048 173.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -96.17 99.52 11.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.539 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.2 t-20 -71.12 105.23 3.3 Favored 'General case' 0 C--N 1.332 -0.182 0 O-C-N 123.66 0.6 . . . . 0.0 110.8 -176.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 77.0 mtp85 -73.58 -38.62 65.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.489 -170.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 62.8 mt -75.15 -45.2 42.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.658 -174.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -95.13 -3.26 48.28 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 -175.607 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.427 HG22 ' O ' ' A' ' 73' ' ' THR . 11.9 m 54.89 43.11 30.48 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 121.441 0.638 . . . . 0.0 110.652 177.546 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.3 m -125.98 148.63 49.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.579 -177.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 76.2 p -94.74 130.27 41.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.127 -179.615 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -123.51 122.27 37.78 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 174.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.402 HG22 ' CD2' ' A' ' 66' ' ' PHE . 39.5 t -125.53 147.05 30.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.796 -176.462 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -146.6 126.45 6.77 Favored Pre-proline 0 CA--C 1.539 0.554 0 CA-C-O 118.683 -0.675 . . . . 0.0 110.37 174.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -75.37 150.89 37.24 Favored 'Trans proline' 0 N--CA 1.498 1.762 0 C-N-CA 121.471 1.447 . . . . 0.0 112.418 178.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 67.3 mt -93.59 138.78 19.55 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 CA-C-O 120.967 0.413 . . . . 0.0 110.263 178.068 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.429 ' OG1' HD23 ' A' ' 84' ' ' LEU . 60.2 p -132.17 157.16 44.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.688 177.019 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -90.91 31.81 5.43 Favored Glycine 0 CA--C 1.528 0.854 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.296 -178.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 54.5 p -111.07 -17.99 13.13 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 174.215 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.429 HD23 ' OG1' ' A' ' 81' ' ' THR . 4.5 mm? -67.82 141.52 56.46 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-O 120.926 0.393 . . . . 0.0 110.976 -175.731 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.7 tt0 -111.96 135.91 51.98 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.661 175.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 68.9 mt -115.39 156.92 24.67 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.945 0.402 . . . . 0.0 110.984 -176.415 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -148.85 142.4 25.39 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 177.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.0 t -99.05 109.14 21.91 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.668 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -106.8 103.71 48.3 Favored Pre-proline 0 C--N 1.328 -0.34 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 172.538 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -70.03 140.3 41.34 Favored 'Trans proline' 0 N--CA 1.497 1.699 0 CA-C-N 120.468 1.203 . . . . 0.0 112.013 -171.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -89.8 9.92 62.85 Favored 'Cis proline' 0 N--CA 1.501 1.922 0 CA-C-N 121.317 1.506 . . . . 0.0 113.756 -4.009 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -88.22 170.21 11.21 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.694 0.283 . . . . 0.0 110.981 -177.259 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 55.9 tp -116.55 133.77 55.62 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 171.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.484 HD11 ' CG2' ' A' ' 102' ' ' ILE . 10.7 tp -125.37 139.09 53.98 Favored 'General case' 0 C--N 1.333 -0.137 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 -174.836 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -143.93 151.96 40.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.998 0.428 . . . . 0.0 110.65 175.256 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 30.3 mtm180 -104.47 144.09 32.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.668 -177.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -129.09 166.5 19.15 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.917 0.865 . . . . 0.0 111.811 -176.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -47.7 148.29 1.58 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.279 -176.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 63.41 30.85 15.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.126 -0.943 . . . . 0.0 112.256 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 67.3 m 65.67 35.25 7.08 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.848 0.356 . . . . 0.0 111.526 166.134 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 27.7 mmt180 -99.26 145.9 26.78 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.708 HD13 ' CH2' ' B' 1345 ' ' TRP . 82.7 mt -114.93 127.47 72.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 121.088 0.47 . . . . 0.0 109.792 -178.377 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -136.78 150.33 48.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.506 179.146 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.52 169.47 25.13 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 111.41 -0.676 . . . . 0.0 111.41 -175.311 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -125.21 138.56 54.12 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.998 0.428 . . . . 0.0 110.625 -178.424 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -106.45 120.37 41.74 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.893 -1.049 . . . . 0.0 109.583 177.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -112.77 139.75 48.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.809 0.337 . . . . 0.0 110.719 -178.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -51.58 -37.51 50.18 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.63 178.444 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.6 t-20 -132.96 135.65 45.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.764 0.316 . . . . 0.0 110.431 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.7 t -61.36 -42.05 98.07 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.051 -177.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 -59.65 -43.23 94.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.362 0.601 . . . . 0.0 110.152 178.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -56.91 -45.01 82.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.432 0.634 . . . . 0.0 109.998 178.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 46.5 t -59.51 -39.75 84.84 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.588 178.18 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -59.51 -45.41 91.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.8 0.334 . . . . 0.0 110.704 -177.149 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 -60.11 -49.35 78.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.054 0.454 . . . . 0.0 110.663 -177.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.718 HG23 HD11 ' A' ' 54' ' ' ILE . 31.7 mm -58.42 -44.86 89.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.974 -178.653 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 55.8 p -59.31 -43.97 92.61 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.708 -177.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.61 -44.03 94.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -178.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.497 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.7 mt -58.47 -48.68 79.98 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.234 0.54 . . . . 0.0 110.514 -178.737 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 52.7 t -58.71 -43.13 87.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.156 -178.507 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 26.9 m120 -58.34 -42.35 86.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.849 0.357 . . . . 0.0 110.664 -178.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.77 -41.16 99.58 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.409 HD22 ' CD2' ' A' ' 63' ' ' HIS . 50.3 mt -63.97 -45.01 91.02 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.794 0.33 . . . . 0.0 111.18 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 36.1 mt -63.03 -44.98 94.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.295 -176.246 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -70.2 -36.34 74.53 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.284 -178.232 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 55.6 p -69.95 159.12 34.32 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.701 0.286 . . . . 0.0 110.503 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 49.3 tttm . . . . . 0 C--O 1.22 -0.495 0 CA-C-O 118.052 -0.975 . . . . 0.0 110.598 -179.645 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.327 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -49.89 140.83 30.24 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 121.32 1.347 . . . . 0.0 111.959 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -118.53 147.58 43.52 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.443 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -81.68 152.92 70.18 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.515 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -87.78 65.4 3.72 Favored 'Trans proline' 0 N--CA 1.49 1.294 0 C-N-CA 121.684 1.59 . . . . 0.0 112.138 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 78.6 mt -57.57 -41.1 80.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.648 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 24.4 tp -124.55 131.32 53.48 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.519 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -82.13 99.95 9.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.473 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -70.79 -39.17 73.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.05 -179.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -88.98 144.17 26.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.874 0.369 . . . . 0.0 110.952 -178.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 78.7 mtp85 -87.63 149.29 24.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.158 178.335 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -85.87 149.18 50.17 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 119.217 -0.42 . . . . 0.0 110.326 -179.581 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -63.84 -179.3 0.71 Allowed 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 121.216 1.277 . . . . 0.0 111.715 177.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -60.26 149.83 74.46 Favored Pre-proline 0 C--N 1.33 -0.241 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 177.212 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 26.7 Cg_exo -57.86 128.79 30.38 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 120.829 1.019 . . . . 0.0 112.595 -172.311 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 74.91 -5.24 33.14 Favored Glycine 0 CA--C 1.533 1.173 0 CA-C-N 115.44 -0.8 . . . . 0.0 113.901 173.12 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -136.39 117.83 14.75 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 118.42 1.11 . . . . 0.0 111.509 -178.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 8.8 ttt -93.34 143.33 26.52 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-O 118.916 -0.564 . . . . 0.0 109.594 172.155 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -49.55 134.83 33.37 Favored 'Trans proline' 0 N--CA 1.497 1.727 0 C-N-CA 121.304 1.336 . . . . 0.0 111.505 172.046 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 49.8 t-20 -102.0 103.1 13.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.886 0.374 . . . . 0.0 111.569 -174.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1338 ' ' LEU . . . . . 0.42 HD12 ' CB ' ' A' ' 43' ' ' TRP . 21.9 mt -94.0 151.24 39.58 Favored Pre-proline 0 C--N 1.33 -0.272 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 172.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -78.99 139.66 15.41 Favored 'Trans proline' 0 N--CA 1.491 1.364 0 C-N-CA 120.915 1.076 . . . . 0.0 111.201 175.415 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 5.4 mmmm -97.28 125.93 43.73 Favored Pre-proline 0 CA--C 1.536 0.432 0 CA-C-O 118.456 -0.783 . . . . 0.0 109.966 178.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -78.18 168.47 21.76 Favored 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 121.257 1.305 . . . . 0.0 111.937 175.387 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -65.71 154.57 73.25 Favored 'Trans proline' 0 N--CA 1.495 1.562 0 C-N-CA 121.259 1.306 . . . . 0.0 111.305 175.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.3 tp -50.01 -29.62 9.01 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -176.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 65.3 t80 -54.96 -36.83 65.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.818 0.342 . . . . 0.0 111.349 -176.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1345 ' ' TRP . . . . . 0.708 ' CH2' HD13 ' A' ' 102' ' ' ILE . 23.6 t90 -61.53 -48.15 82.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.423 -176.402 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -61.89 -49.15 77.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.121 0.486 . . . . 0.0 110.366 -178.266 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -58.82 -44.96 90.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.871 -176.51 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -59.04 -46.84 87.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.623 -176.358 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.38 -47.19 86.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.052 0.453 . . . . 0.0 110.652 -177.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -58.87 -43.85 90.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.013 -176.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 74.6 mttt -64.85 -46.41 81.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.294 -177.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -54.96 -45.85 74.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.252 -178.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -65.0 -36.97 86.11 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.062 179.038 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -70.67 141.02 51.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.77 0.319 . . . . 0.0 110.447 179.257 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 83.4 mt . . . . . 0 C--O 1.22 -0.46 0 CA-C-O 117.962 -1.018 . . . . 0.0 110.53 -179.778 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.3 0 N-CA-C 109.591 -1.404 . . . . 0.0 109.591 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -51.47 130.57 33.58 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 CA-C-N 118.901 1.351 . . . . 0.0 112.042 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -59.49 -41.22 89.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.713 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 86.4 mtp -57.45 -39.4 76.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.905 -179.593 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -77.75 123.42 26.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.845 0.355 . . . . 0.0 110.617 -179.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -75.59 152.11 37.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.529 179.655 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 29.7 tp -56.9 -40.67 76.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.674 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.1 mmm -137.41 129.06 28.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.326 179.48 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -178.61 134.11 0.14 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.513 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -91.17 113.45 25.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.539 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -62.88 -35.27 79.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.331 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.1 t -56.6 -40.69 75.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.904 0.383 . . . . 0.0 110.662 -178.218 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.6 mm -59.93 -45.31 95.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.199 -178.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.9 m -59.14 -44.62 92.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.467 -178.03 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -59.43 -46.15 89.54 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.593 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 88.4 mtp -58.17 -43.72 87.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.053 0.454 . . . . 0.0 110.423 -178.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -59.99 -48.65 80.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.268 -178.366 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.629 ' HA ' HD12 ' A' ' 14' ' ' ILE . 9.8 tp -60.72 -32.89 72.13 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.729 -0.388 . . . . 0.0 111.175 -179.094 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.22 -49.86 74.08 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.726 0.298 . . . . 0.0 110.632 179.003 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.8 -42.13 88.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.057 0.456 . . . . 0.0 110.456 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.715 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 97.7 mt -54.28 -52.88 34.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.627 178.476 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -53.26 -23.7 9.58 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.407 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -57.93 -34.65 70.11 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 120.611 0.244 . . . . 0.0 111.575 -178.049 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 48.0 mm -107.77 -42.83 6.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.973 0.416 . . . . 0.0 110.208 -177.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -117.16 77.43 9.39 Favored Pre-proline 0 CA--C 1.535 0.372 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.808 -179.272 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -55.72 -21.19 31.13 Favored 'Trans proline' 0 N--CA 1.498 1.752 0 C-N-CA 121.524 1.482 . . . . 0.0 113.447 -174.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.7 p90 -87.47 -2.15 58.42 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -174.31 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.33 127.21 31.34 Favored 'General case' 0 N--CA 1.461 0.095 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 177.133 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -97.54 -40.35 8.69 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.653 -175.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -154.79 157.44 37.95 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.3 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 35.4 mt -93.87 136.75 24.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.824 177.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.5 t -87.41 -44.98 16.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.68 177.272 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.504 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -158.35 157.94 33.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.845 178.561 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.2 p -142.87 132.9 24.32 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.999 0.428 . . . . 0.0 111.266 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.6 t -109.98 125.74 53.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.663 176.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.1 m -54.84 -38.93 68.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.169 -172.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -148.89 126.45 11.67 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.247 0.546 . . . . 0.0 111.76 -178.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.498 HG22 ' CD1' ' A' ' 107' ' ' PHE . 97.3 t -145.2 140.19 22.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.333 -178.0 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.91 149.84 51.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.722 0.296 . . . . 0.0 111.268 -177.244 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.481 ' HD2' HG21 ' A' ' 46' ' ' THR . 25.6 t80 -100.77 130.33 46.78 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.549 -176.742 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -126.23 143.96 50.95 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.73 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 96.2 m -123.51 146.73 47.86 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -108.64 132.0 54.33 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.962 0.41 . . . . 0.0 110.333 176.481 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -105.18 114.22 28.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.82 176.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 84.8 p -70.8 -29.69 65.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.0 -0.546 . . . . 0.0 112.338 -175.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.3 t -58.9 -39.23 80.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.805 0.336 . . . . 0.0 110.943 -177.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -100.58 -17.88 16.86 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.9 t30 69.82 48.05 0.59 Allowed 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.596 0.712 . . . . 0.0 109.46 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -153.57 151.62 29.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.774 -178.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -88.37 142.78 27.45 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.393 178.02 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -124.99 130.39 52.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.86 176.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.5 pttp -75.02 141.26 43.94 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 177.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.481 HG21 ' HD2' ' A' ' 33' ' ' PHE . 67.5 p -92.3 175.55 6.8 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.699 -0.401 . . . . 0.0 110.067 -179.019 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -85.31 13.28 6.72 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.7 t -107.95 106.36 20.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-O 121.014 0.435 . . . . 0.0 110.351 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -132.1 112.2 12.12 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 174.344 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.64 176.53 38.95 Favored Glycine 0 CA--C 1.52 0.389 0 C-N-CA 120.184 -1.007 . . . . 0.0 112.222 -168.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.494 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.97 135.37 36.91 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 175.198 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.445 ' HB3' HG21 ' A' ' 31' ' ' VAL . 7.0 t80 -98.94 127.75 44.94 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.107 -176.722 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.494 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 9.2 m-85 -131.75 141.97 49.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.331 177.723 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.64 HD11 HG23 ' A' ' 116' ' ' ILE . 63.9 mt -101.59 129.24 53.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 173.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.715 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 10.3 m-30 -108.49 137.38 46.54 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.791 0.329 . . . . 0.0 111.213 -175.67 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 57.6 t60 -121.35 143.3 49.27 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.289 176.191 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 29.1 ttp180 -142.01 153.84 44.56 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.303 177.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -86.85 28.17 0.92 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.152 -179.198 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -155.78 152.87 29.0 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -63.95 133.55 95.62 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-O 118.5 -0.762 . . . . 0.0 110.243 -176.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -68.19 140.92 57.98 Favored 'Cis proline' 0 N--CA 1.499 1.794 0 CA-C-N 121.703 1.644 . . . . 0.0 111.45 -0.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -66.74 -41.32 88.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.135 -176.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.414 ' HB3' HD12 ' A' ' 80' ' ' ILE . 74.0 m80 -142.44 143.42 32.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.7 0.762 . . . . 0.0 111.249 -175.523 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.6 t -150.31 151.95 33.72 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.847 -179.041 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 48.2 mt -112.35 138.4 41.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 -177.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -131.79 142.09 49.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.03 -177.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.8 mt -123.06 131.87 72.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.252 0.549 . . . . 0.0 109.783 172.383 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -97.8 99.58 10.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.426 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -72.03 107.28 4.66 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 123.618 0.573 . . . . 0.0 110.992 -175.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -73.4 -41.96 62.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.278 -171.678 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 74.7 mt -70.3 -45.13 66.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.671 -175.236 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 39.9 m-20 -95.09 -3.23 48.48 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -175.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.8 p 51.07 42.31 28.43 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.523 0.678 . . . . 0.0 111.065 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 38.5 m -125.2 149.08 48.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.164 -179.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.4 p -98.2 137.73 36.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.999 -178.125 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -132.97 122.19 23.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.118 175.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 p -125.62 150.38 30.89 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.049 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -148.71 132.8 8.68 Favored Pre-proline 0 CA--C 1.538 0.503 0 CA-C-O 118.879 -0.581 . . . . 0.0 110.401 174.769 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -75.46 150.95 36.93 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 121.578 1.518 . . . . 0.0 112.29 179.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.414 HD12 ' HB3' ' A' ' 63' ' ' HIS . 69.7 mt -90.51 136.31 24.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.2 177.607 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.6 p -132.14 158.49 41.53 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.839 177.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -95.7 35.46 4.3 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.058 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.3 p -109.0 -23.33 11.74 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 173.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.89 147.68 51.34 Favored 'General case' 0 C--O 1.231 0.082 0 CA-C-O 120.887 0.375 . . . . 0.0 111.207 -176.393 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 59.3 tt0 -118.56 135.91 54.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.799 175.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 51.6 mt -114.25 161.05 18.34 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.715 -176.552 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -150.06 142.68 24.53 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 177.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.0 t -98.5 109.15 21.95 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.444 -0.502 . . . . 0.0 110.588 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 -106.9 103.75 48.74 Favored Pre-proline 0 C--N 1.328 -0.344 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 171.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -70.26 143.15 47.59 Favored 'Trans proline' 0 N--CA 1.497 1.734 0 CA-C-N 120.496 1.213 . . . . 0.0 112.003 -171.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -91.17 14.73 49.52 Favored 'Cis proline' 0 N--CA 1.499 1.798 0 CA-C-N 120.964 1.38 . . . . 0.0 113.561 -3.75 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -97.0 172.64 7.73 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.458 0.171 . . . . 0.0 110.58 -177.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 52.5 tp -114.5 135.07 54.52 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 173.031 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.419 HD21 ' HZ2' ' B' 1345 ' ' TRP . 9.4 tp -127.17 139.56 52.87 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 -174.273 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 19.6 p90 -146.61 160.9 41.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.91 0.386 . . . . 0.0 110.614 175.411 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 30.5 mtm105 -101.9 146.15 28.24 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.471 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -127.26 164.64 21.27 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.78 0.8 . . . . 0.0 111.732 -176.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -48.0 147.51 2.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.203 -176.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 63.23 30.95 15.78 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.152 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 46.5 t 66.62 35.2 5.45 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.896 0.379 . . . . 0.0 111.583 166.342 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -100.74 152.63 20.25 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.255 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 73.9 mt -110.19 129.18 65.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 -179.239 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -138.3 150.25 46.45 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.789 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -144.29 169.34 26.38 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 111.359 -0.696 . . . . 0.0 111.359 -176.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -125.34 140.96 52.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.948 0.404 . . . . 0.0 110.809 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 17.2 t90 -108.38 127.74 54.15 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.81 175.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.498 ' CD1' HG22 ' A' ' 31' ' ' VAL . 79.4 m-85 -115.26 142.02 47.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.762 0.315 . . . . 0.0 110.356 178.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -50.93 -38.25 49.05 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.78 178.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -133.39 137.27 45.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.309 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.0 m -59.81 -41.74 91.92 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.957 -177.307 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -58.17 -42.24 85.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.285 0.564 . . . . 0.0 110.18 178.211 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -57.26 -44.78 84.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.508 0.67 . . . . 0.0 109.909 178.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 43.5 t -59.22 -37.01 76.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.797 176.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -63.11 -51.73 65.39 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 121.208 -0.197 . . . . 0.0 111.182 -174.228 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 29.6 ptt180 -64.76 -42.41 95.14 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.35 -0.54 . . . . 0.0 111.339 -175.005 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.64 HG23 HD11 ' A' ' 54' ' ' ILE . 26.5 mm -60.04 -48.13 89.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.175 0 C-N-CA 120.507 -0.477 . . . . 0.0 109.883 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 66.5 p -59.32 -43.2 92.71 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.832 0.349 . . . . 0.0 110.644 -177.195 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.77 -43.73 94.47 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.631 -0.987 . . . . 0.0 110.631 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.504 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.1 mt -57.93 -47.78 81.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.214 0.531 . . . . 0.0 110.497 -178.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 49.3 t -59.01 -44.14 90.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.035 -179.12 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -57.36 -42.74 82.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.689 -178.466 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.12 -46.02 95.37 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.006 -0.838 . . . . 0.0 111.006 -178.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 56.9 mt -57.83 -43.07 85.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.016 0.436 . . . . 0.0 110.507 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 39.3 mt -60.25 -40.2 89.46 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.802 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 31.9 pttt -94.63 11.15 32.13 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 64.7 m -117.22 147.11 42.79 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.875 0.369 . . . . 0.0 110.401 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt . . . . . 0 C--O 1.22 -0.483 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.494 -179.958 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.294 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -49.86 148.72 12.16 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 121.342 1.361 . . . . 0.0 111.955 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -95.16 125.64 39.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.512 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -65.92 154.24 89.72 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.568 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -87.29 33.04 0.42 Allowed 'Trans proline' 0 N--CA 1.49 1.316 0 C-N-CA 121.682 1.588 . . . . 0.0 112.37 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 29.8 tp -56.75 -39.97 74.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.791 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.0 mt -84.26 142.65 30.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.394 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -90.1 116.15 27.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.608 -179.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -62.54 -40.61 97.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.725 179.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -144.01 167.11 23.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.695 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 37.3 ptt-85 -98.44 142.83 29.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.7 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -65.24 156.42 81.39 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.688 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -68.29 146.44 69.31 Favored 'Trans proline' 0 N--CA 1.495 1.61 0 C-N-CA 121.244 1.296 . . . . 0.0 112.012 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -125.95 99.97 31.15 Favored Pre-proline 0 CA--C 1.533 0.306 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.998 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -57.9 128.96 31.01 Favored 'Trans proline' 0 N--CA 1.497 1.69 0 C-N-CA 121.103 1.202 . . . . 0.0 111.506 -178.309 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 102.02 -5.13 52.94 Favored Glycine 0 CA--C 1.537 1.414 0 CA-C-N 115.779 -0.646 . . . . 0.0 113.222 -178.426 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -84.29 145.69 28.15 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 118.165 0.982 . . . . 0.0 110.48 177.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 28.9 ttp -66.39 143.45 98.25 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 119.067 -0.492 . . . . 0.0 110.045 -179.524 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -58.05 156.91 27.0 Favored 'Trans proline' 0 N--CA 1.496 1.656 0 C-N-CA 121.242 1.294 . . . . 0.0 111.825 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 10.9 p-10 -103.99 111.02 23.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.902 -179.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 8.3 mt -79.76 130.23 68.14 Favored Pre-proline 0 CA--C 1.533 0.307 0 CA-C-O 118.169 -0.92 . . . . 0.0 109.412 177.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -79.14 139.55 15.08 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 CA-C-N 120.615 1.255 . . . . 0.0 111.155 174.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 41.6 mtmt -97.38 126.02 43.21 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-O 118.453 -0.784 . . . . 0.0 110.32 179.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -64.55 167.8 14.38 Favored 'Trans proline' 0 N--CA 1.498 1.757 0 CA-C-N 120.564 1.237 . . . . 0.0 111.619 175.412 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -56.55 157.11 19.74 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 121.402 1.401 . . . . 0.0 111.445 178.627 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 12.3 tp -50.01 -29.96 9.68 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -176.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 58.2 t80 -54.95 -37.42 66.43 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.921 0.391 . . . . 0.0 111.161 -177.815 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1345 ' ' TRP . . . . . 0.419 ' HZ2' HD21 ' A' ' 94' ' ' LEU . 43.6 t90 -60.2 -48.05 83.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.225 -177.715 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -61.88 -47.94 82.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.026 0.441 . . . . 0.0 110.626 -177.177 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -59.63 -45.09 93.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.86 -177.099 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 42.7 tp10 -59.23 -46.17 89.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.695 -176.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.26 -48.34 82.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.039 0.447 . . . . 0.0 110.751 -177.364 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -59.29 -43.02 92.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.15 -176.597 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 83.5 tttt -64.22 -47.14 80.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.143 -177.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 57.2 tp60 -54.99 -47.97 73.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.15 -178.389 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 42.2 tp10 -64.93 -37.06 86.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.149 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -129.96 112.44 13.51 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.882 0.372 . . . . 0.0 110.622 -179.261 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 78.4 mt . . . . . 0 C--O 1.221 -0.426 0 CA-C-O 117.962 -1.018 . . . . 0.0 110.607 -179.955 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.257 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -67.57 132.63 27.61 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 121.307 1.338 . . . . 0.0 111.965 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -58.67 -40.78 84.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.746 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 65.0 mtt -91.42 141.85 28.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.656 -179.45 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -68.12 148.33 51.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.634 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -138.17 173.66 11.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.484 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 30.0 tp -57.09 -41.53 79.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.565 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt -104.66 133.97 48.62 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.311 179.11 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.563 ' HB1' HG13 ' A' ' 6' ' ' ILE . . . -150.55 168.11 25.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.693 -179.398 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -57.48 161.76 3.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.74 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -59.98 -32.82 71.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.48 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.4 m -56.11 -40.46 73.74 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.908 0.385 . . . . 0.0 110.639 -178.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.563 HG13 ' HB1' ' A' ' 2' ' ' ALA . 44.7 mm -59.56 -44.82 94.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.128 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.5 m -58.62 -45.07 90.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.061 0.458 . . . . 0.0 110.439 -178.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -59.26 -45.38 91.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.58 -178.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 89.2 mtp -58.27 -42.4 86.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.449 -178.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -60.1 -49.93 75.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.287 -178.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.736 ' HA ' HD12 ' A' ' 14' ' ' ILE . 12.7 tp -60.53 -31.02 70.12 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.323 -179.303 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.76 -50.92 67.17 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.676 0.274 . . . . 0.0 110.733 178.392 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.36 -40.23 81.7 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.953 0.406 . . . . 0.0 110.674 179.35 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.736 HD12 ' HA ' ' A' ' 11' ' ' LEU . 97.7 mt -54.24 -52.9 33.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.485 177.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -51.55 -22.38 3.2 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.9 mmtt -58.72 -35.09 72.12 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 122.296 -0.253 . . . . 0.0 111.631 -178.097 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 48.2 mm -108.19 -43.26 6.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.908 0.385 . . . . 0.0 110.116 -177.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -117.36 77.3 9.98 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.129 -176.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -54.84 -22.45 29.86 Favored 'Trans proline' 0 N--CA 1.498 1.747 0 C-N-CA 121.5 1.466 . . . . 0.0 113.33 -176.256 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.0 p90 -88.65 8.74 27.02 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -175.011 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -88.61 123.81 33.44 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 174.399 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.475 ' O ' HD21 ' A' ' 11' ' ' LEU . 28.4 mmtp -104.86 -40.06 6.07 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.991 -173.107 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -132.02 145.63 51.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.145 -176.07 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.434 HG13 HD13 ' A' ' 11' ' ' LEU . 63.0 mt -96.66 128.13 48.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.87 -0.604 . . . . 0.0 109.731 173.117 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.3 t -89.26 -47.11 15.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.047 0.451 . . . . 0.0 109.965 -179.569 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.478 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.1 t0 -154.22 150.26 27.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.023 177.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.8 p -138.46 131.95 30.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.059 0.456 . . . . 0.0 110.743 179.356 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.4 t -104.74 126.9 52.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.482 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.2 m -53.91 -38.03 64.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.366 -171.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -151.92 127.82 10.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.225 0.536 . . . . 0.0 111.724 -178.648 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.424 HG22 ' CD2' ' A' ' 107' ' ' PHE . 94.9 t -145.15 136.99 20.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.542 -177.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -126.36 149.86 48.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.173 -178.178 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.682 ' CD2' HG21 ' A' ' 46' ' ' THR . 36.3 t80 -96.99 133.09 42.12 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.334 0.588 . . . . 0.0 111.788 -176.699 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -127.04 137.98 53.15 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.283 177.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.4 m -119.03 143.46 47.08 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 178.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -107.93 130.57 55.02 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.008 0.432 . . . . 0.0 110.246 177.45 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -101.76 113.74 27.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.063 176.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 86.1 p -70.88 -25.79 62.95 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -177.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.0 m -58.89 -36.4 74.61 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 121.121 -0.232 . . . . 0.0 111.244 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -113.95 -12.04 12.7 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -177.059 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 58.7 t30 69.74 50.51 0.49 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-O 121.704 0.764 . . . . 0.0 109.592 179.35 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.7 tp10 -148.01 146.93 29.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.908 -178.315 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.453 ' CB ' HD12 ' B' 1338 ' ' LEU . 83.7 m95 -89.2 141.0 28.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.176 176.651 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -121.42 126.31 49.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.229 -0.441 . . . . 0.0 109.916 176.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -73.17 135.14 44.6 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 177.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.682 HG21 ' CD2' ' A' ' 33' ' ' PHE . 67.9 p -92.35 162.1 14.4 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.24 -177.869 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -75.95 5.68 6.21 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.3 t -97.16 106.42 18.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 121.091 0.472 . . . . 0.0 110.29 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -131.73 115.5 16.09 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 176.164 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.5 38.96 Favored Glycine 0 CA--C 1.52 0.392 0 C-N-CA 120.063 -1.065 . . . . 0.0 112.392 -169.456 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.5 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -80.94 136.47 36.04 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.373 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -102.18 123.8 46.65 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -175.641 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.5 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 4.5 m-85 -128.53 140.92 51.55 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.644 0.259 . . . . 0.0 110.721 177.165 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.492 HD11 HG23 ' A' ' 116' ' ' ILE . 74.8 mt -101.63 127.35 55.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 170.71 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.591 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 11.2 m-30 -108.53 140.62 41.61 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.018 0.437 . . . . 0.0 111.665 -177.35 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -108.82 143.38 38.08 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.934 173.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -140.89 145.51 36.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.028 178.235 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -86.93 28.17 0.93 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.217 -0.447 . . . . 0.0 112.03 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.28 164.15 36.7 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -63.96 128.83 93.44 Favored Pre-proline 0 CA--C 1.539 0.557 0 CA-C-O 118.401 -0.809 . . . . 0.0 110.024 -177.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.61 140.9 69.9 Favored 'Cis proline' 0 N--CA 1.497 1.719 0 CA-C-N 121.909 1.717 . . . . 0.0 111.738 -1.312 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -63.97 -41.37 97.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.986 -177.569 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.442 ' HB3' HD12 ' A' ' 80' ' ' ILE . 73.9 m80 -143.15 137.94 29.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.315 0.579 . . . . 0.0 110.911 -177.233 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.0 t -150.04 151.63 33.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.421 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 56.7 mt -115.08 139.81 39.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.961 -177.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -131.79 142.09 49.65 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.082 -178.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.1 mt -119.84 126.69 75.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.207 0.527 . . . . 0.0 109.771 171.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -94.66 99.56 11.65 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.648 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -73.28 105.96 4.91 Favored 'General case' 0 C--N 1.332 -0.16 0 O-C-N 123.687 0.617 . . . . 0.0 110.934 -175.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 25.9 mmt85 -74.36 -40.48 62.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.447 -170.642 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 45.0 mt -74.07 -45.16 51.05 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.77 0.319 . . . . 0.0 111.411 -175.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 29.8 t-20 -95.04 -3.2 48.7 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -175.347 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.5 p 50.95 43.22 28.83 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.496 0.665 . . . . 0.0 111.147 178.11 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 37.2 m -122.97 142.94 50.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.143 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.2 p -91.83 127.97 37.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.29 -178.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -117.46 122.15 42.96 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 175.527 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 p -125.56 146.96 30.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-O 120.705 0.288 . . . . 0.0 111.08 -178.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -149.83 126.48 5.3 Favored Pre-proline 0 CA--C 1.539 0.546 0 CA-C-O 118.557 -0.735 . . . . 0.0 110.345 175.212 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -75.36 150.86 37.22 Favored 'Trans proline' 0 N--CA 1.498 1.765 0 C-N-CA 121.388 1.392 . . . . 0.0 112.105 177.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.442 HD12 ' HB3' ' A' ' 63' ' ' HIS . 63.1 mt -90.67 135.95 25.28 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 CA-C-O 120.937 0.399 . . . . 0.0 110.376 179.091 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.9 p -132.12 154.71 49.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.667 177.111 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -93.79 35.82 4.0 Favored Glycine 0 CA--C 1.525 0.68 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.048 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 46.7 p -111.0 -21.08 12.18 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 111.995 0.368 . . . . 0.0 111.995 174.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.6 mt -68.43 147.19 52.42 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-O 120.909 0.385 . . . . 0.0 111.367 -175.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.9 tt0 -114.31 135.82 53.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.768 176.309 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 60.4 mt -115.6 157.58 23.93 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.959 0.409 . . . . 0.0 110.882 -176.393 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -149.22 142.39 25.01 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 178.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.1 t -99.03 109.14 21.93 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.613 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -106.8 103.73 48.36 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 172.188 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -70.55 142.99 45.8 Favored 'Trans proline' 0 N--CA 1.497 1.72 0 CA-C-N 120.546 1.231 . . . . 0.0 112.138 -170.186 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -90.62 14.27 50.96 Favored 'Cis proline' 0 N--CA 1.5 1.901 0 CA-C-N 121.049 1.41 . . . . 0.0 113.534 -4.254 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -94.89 170.42 9.44 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 122.378 0.271 . . . . 0.0 110.758 -177.631 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 54.1 tp -116.1 133.2 56.28 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 173.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.8 tp -124.67 139.98 53.36 Favored 'General case' 0 C--N 1.334 -0.101 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 -173.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -144.5 153.09 41.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.972 0.415 . . . . 0.0 110.564 175.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.6 mtm180 -103.89 144.35 31.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.739 -177.257 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -127.57 163.05 25.02 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.893 0.854 . . . . 0.0 111.761 -176.485 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -47.84 149.24 1.35 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.14 -177.536 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 87.5 mtt-85 63.5 30.87 15.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.155 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 34.9 m 66.27 35.16 6.07 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.913 0.387 . . . . 0.0 111.628 165.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 40.3 mtp180 -99.87 147.32 25.65 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 82.9 mt -113.33 126.92 70.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -178.631 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -136.12 148.36 48.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.429 -178.397 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -144.73 169.3 26.62 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 120.771 -0.728 . . . . 0.0 111.651 -178.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -126.0 141.85 51.78 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.292 -0.454 . . . . 0.0 110.565 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 77.5 t90 -106.63 124.02 48.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.511 174.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.424 ' CD2' HG22 ' A' ' 31' ' ' VAL . 59.5 m-85 -109.65 140.19 43.78 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 123.312 0.383 . . . . 0.0 110.523 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -50.33 -37.13 35.15 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.845 178.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 39.1 t-20 -133.72 135.49 44.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.345 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.2 m -61.63 -42.77 99.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.056 -177.593 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -59.43 -43.64 93.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.373 0.606 . . . . 0.0 110.084 179.084 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -56.56 -43.7 80.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.133 178.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 51.4 t -59.31 -40.99 87.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.353 177.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -58.88 -44.57 91.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.8 0.333 . . . . 0.0 110.627 -177.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -59.99 -49.74 76.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.944 0.402 . . . . 0.0 110.649 -177.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.492 HG23 HD11 ' A' ' 54' ' ' ILE . 29.8 mm -58.46 -45.31 90.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.099 0.476 . . . . 0.0 110.067 -178.344 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 61.1 p -59.41 -43.03 93.1 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.73 -177.719 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.73 -43.99 94.3 Favored Glycine 0 CA--C 1.523 0.545 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 -178.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.478 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.8 mt -58.4 -48.21 81.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.074 0.464 . . . . 0.0 110.459 -178.732 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.442 ' HA ' HD12 ' A' ' 123' ' ' LEU . 55.4 t -59.0 -42.57 86.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.167 -179.225 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.467 ' HA ' HD12 ' A' ' 124' ' ' LEU . 26.6 m120 -57.38 -42.07 81.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.896 0.379 . . . . 0.0 110.605 -179.329 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -59.65 -44.63 96.72 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.442 HD12 ' HA ' ' A' ' 120' ' ' VAL . 58.0 mt -57.68 -42.99 84.74 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.98 0.419 . . . . 0.0 110.429 179.365 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.467 HD12 ' HA ' ' A' ' 121' ' ' ASN . 17.7 mt -58.18 -41.88 84.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.548 179.121 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 38.0 pttt -96.47 11.14 36.07 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 29.7 t -114.4 144.45 43.28 Favored 'General case' 0 N--CA 1.462 0.14 0 O-C-N 122.141 -0.349 . . . . 0.0 110.453 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.1 mttt . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 118.043 -0.979 . . . . 0.0 110.566 179.982 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.343 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -65.16 142.69 74.96 Favored 'Trans proline' 0 N--CA 1.497 1.687 0 CA-C-N 119.296 1.548 . . . . 0.0 111.936 -176.033 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -120.35 155.4 33.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.492 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -62.41 154.1 73.58 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.572 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.25 132.41 19.37 Favored 'Trans proline' 0 N--CA 1.495 1.589 0 C-N-CA 121.298 1.332 . . . . 0.0 112.117 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 78.6 mt -63.79 -38.65 91.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.937 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 27.2 tp -78.6 139.0 38.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.86 0.362 . . . . 0.0 110.605 -179.374 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 51.7 tp60 -87.33 129.79 34.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.502 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -57.71 -38.67 75.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.048 -179.101 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -56.56 145.51 28.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.876 0.37 . . . . 0.0 110.75 -179.63 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 34.4 ttm180 -72.38 144.66 48.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.705 -179.593 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -57.3 164.29 2.74 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.453 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -48.14 142.01 16.87 Favored 'Trans proline' 0 N--CA 1.495 1.58 0 C-N-CA 121.425 1.417 . . . . 0.0 112.259 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 29.7 p90 -138.99 163.86 43.37 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.51 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -57.85 129.02 31.31 Favored 'Trans proline' 0 N--CA 1.495 1.596 0 C-N-CA 121.19 1.26 . . . . 0.0 111.664 -178.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 100.74 -5.14 56.59 Favored Glycine 0 CA--C 1.535 1.318 0 CA-C-N 115.948 -0.569 . . . . 0.0 113.424 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -64.61 140.34 58.86 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 118.206 1.003 . . . . 0.0 110.42 177.632 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 6.8 ttt -61.29 139.24 94.68 Favored Pre-proline 0 CA--C 1.534 0.364 0 CA-C-O 118.898 -0.572 . . . . 0.0 109.782 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.11 148.9 40.34 Favored 'Trans proline' 0 N--CA 1.495 1.581 0 C-N-CA 121.243 1.296 . . . . 0.0 111.926 178.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 52.9 t-20 -94.88 104.82 16.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.626 -179.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1338 ' ' LEU . . . . . 0.453 HD12 ' CB ' ' A' ' 43' ' ' TRP . 18.9 mt -70.81 134.67 85.84 Favored Pre-proline 0 C--O 1.234 0.279 0 CA-C-O 118.461 -0.781 . . . . 0.0 109.488 179.414 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.21 139.65 15.04 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 CA-C-N 120.435 1.191 . . . . 0.0 111.083 174.088 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 19.8 mtmm -97.31 125.94 43.64 Favored Pre-proline 0 CA--C 1.535 0.401 0 CA-C-O 118.514 -0.755 . . . . 0.0 110.188 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -63.25 161.15 31.69 Favored 'Trans proline' 0 N--CA 1.498 1.759 0 CA-C-N 120.563 1.237 . . . . 0.0 111.553 176.045 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -49.19 157.04 2.07 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 121.38 1.386 . . . . 0.0 111.812 178.03 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1343 ' ' LEU . . . . . 0.531 ' H ' HD12 ' B' 1343 ' ' LEU . 6.2 mp -49.99 -25.58 3.47 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -176.492 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 68.8 t80 -55.95 -38.46 70.39 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.809 0.337 . . . . 0.0 111.084 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 50.5 t90 -60.88 -48.08 83.42 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.509 -176.473 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -63.61 -49.27 73.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.067 0.46 . . . . 0.0 110.785 -177.545 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -59.34 -43.86 92.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.926 -176.544 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -59.19 -48.32 82.04 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.638 -176.164 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.17 -49.12 78.87 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.733 -177.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -59.6 -41.48 90.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.226 -176.046 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 26.4 tptp -64.81 -48.33 74.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.126 -177.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -55.03 -47.42 74.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.227 -178.19 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -64.95 -36.83 85.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.215 178.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -63.35 148.15 49.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.801 0.334 . . . . 0.0 110.608 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1355 ' ' LEU . . . . . 0.479 ' C ' HD23 ' B' 1355 ' ' LEU . 6.5 tt . . . . . 0 C--O 1.22 -0.495 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.586 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.302 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -67.88 139.53 47.81 Favored 'Trans proline' 0 N--CA 1.496 1.636 0 CA-C-N 118.906 1.353 . . . . 0.0 111.96 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -57.31 -41.63 80.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.613 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 72.1 mtm -104.82 157.83 16.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.565 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -141.19 152.75 44.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.581 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -67.9 151.23 47.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.552 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 79.0 mt -56.78 -40.53 76.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.696 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.5 mtp -101.31 139.75 36.55 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.444 179.188 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.534 ' HB1' HG13 ' A' ' 6' ' ' ILE . . . -140.55 155.77 46.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.505 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.3 p30 -78.0 -177.98 5.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.66 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -63.38 -31.44 72.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.854 -179.014 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.1 m -57.36 -44.58 84.5 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.911 0.386 . . . . 0.0 110.589 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.534 HG13 ' HB1' ' A' ' 2' ' ' ALA . 48.2 mm -59.81 -44.7 94.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.216 -178.271 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.0 m -59.58 -44.05 93.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.571 -177.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -59.92 -45.2 93.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.563 -178.48 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 87.8 mtp -58.26 -44.21 88.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.093 0.473 . . . . 0.0 110.458 -178.273 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -60.75 -49.18 78.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.296 -178.4 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.66 ' HA ' HD12 ' A' ' 14' ' ' ILE . 10.4 tp -59.75 -33.02 71.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.058 -178.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.34 -50.58 69.44 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.649 0.262 . . . . 0.0 110.851 179.517 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.96 -41.67 83.38 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.944 0.402 . . . . 0.0 110.404 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.677 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 93.9 mt -54.13 -52.98 32.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.724 178.577 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -51.93 -24.76 6.85 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -178.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 65.8 mmtt -59.24 -33.73 71.37 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -177.415 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.6 mm -109.77 -43.67 5.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.0 0.429 . . . . 0.0 110.071 -176.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -117.61 77.15 10.7 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.968 -178.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -55.2 -20.49 24.78 Favored 'Trans proline' 0 N--CA 1.497 1.731 0 C-N-CA 121.47 1.447 . . . . 0.0 113.531 -175.357 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.3 p90 -90.61 11.62 21.44 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -174.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -88.15 131.21 34.8 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 174.154 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.572 ' O ' HD21 ' A' ' 11' ' ' LEU . 99.1 mttt -108.31 -38.69 5.66 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.745 0.307 . . . . 0.0 111.145 -175.17 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -135.86 147.65 48.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.007 0.432 . . . . 0.0 111.183 -175.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.411 HD11 HD12 ' A' ' 14' ' ' ILE . 21.8 mt -99.39 134.28 39.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 171.752 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.6 t -92.83 -47.13 13.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.242 -0.435 . . . . 0.0 109.877 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.504 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.1 t0 -152.23 155.06 36.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.014 178.701 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.1 p -142.7 131.95 23.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.171 0.51 . . . . 0.0 110.895 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.6 t -107.27 126.58 52.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.695 177.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.7 t -54.38 -38.67 66.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.154 -172.309 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 -150.7 127.21 10.78 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.294 0.569 . . . . 0.0 111.689 -179.026 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.439 HG21 ' HB3' ' A' ' 52' ' ' PHE . 92.8 t -144.84 138.55 22.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.336 -178.094 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.59 149.81 50.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.303 -177.089 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -99.68 131.2 45.82 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.259 0.552 . . . . 0.0 111.833 -176.151 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -123.85 141.75 51.75 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.466 178.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 72.5 m -120.99 147.01 46.08 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -107.79 131.9 53.97 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.951 0.405 . . . . 0.0 110.416 175.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.6 t-20 -104.31 115.65 30.76 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.977 178.04 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 27.1 t -67.65 -33.12 74.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.9 -177.362 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.1 m -60.56 -39.79 89.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.752 0.31 . . . . 0.0 110.887 -177.39 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -93.13 -21.52 19.63 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 19.2 t30 69.13 42.69 1.2 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-O 121.288 0.566 . . . . 0.0 109.809 -177.661 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.0 mt-10 -151.34 164.17 37.29 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.156 -177.265 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.428 ' CB ' HD12 ' B' 1338 ' ' LEU . 83.9 m95 -94.12 141.66 28.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.352 177.537 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.9 tp10 -124.97 127.53 47.17 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 177.003 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.7 ttpp -73.64 139.15 45.25 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 177.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 52.4 p -92.23 172.23 8.55 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.071 -178.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -84.08 12.6 6.13 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 178.327 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.7 t -104.05 106.43 20.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-O 121.068 0.461 . . . . 0.0 110.346 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -132.22 114.43 14.45 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 176.338 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.59 176.51 38.91 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.022 -1.085 . . . . 0.0 112.3 -169.362 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.484 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -81.31 135.81 35.73 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 175.415 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.439 ' HB3' HG21 ' A' ' 31' ' ' VAL . 6.2 t80 -99.42 127.34 45.46 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.883 -0.327 . . . . 0.0 110.126 -176.544 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.484 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 7.4 m-85 -131.67 142.46 49.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.723 0.297 . . . . 0.0 110.339 177.294 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.673 HD11 HG23 ' A' ' 116' ' ' ILE . 68.6 mt -101.61 127.95 54.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 171.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.677 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.3 m-30 -108.53 135.55 49.61 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.855 0.36 . . . . 0.0 111.302 -175.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 68.8 t60 -109.71 143.28 39.72 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.104 174.207 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 60.5 ttt180 -141.92 146.75 36.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.233 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -86.88 28.11 0.93 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.112 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.7 166.16 33.53 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -63.99 127.64 92.03 Favored Pre-proline 0 CA--C 1.539 0.537 0 CA-C-O 118.445 -0.788 . . . . 0.0 110.066 -177.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -75.98 140.94 68.94 Favored 'Cis proline' 0 N--CA 1.497 1.702 0 CA-C-N 121.89 1.711 . . . . 0.0 111.765 -1.172 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -62.45 -42.26 99.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.945 -178.057 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.4 ' HB3' HD12 ' A' ' 80' ' ' ILE . 73.3 m80 -142.84 138.58 30.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.436 0.636 . . . . 0.0 110.891 -177.131 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.8 t -150.19 151.73 33.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.311 -178.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 47.7 mt -110.31 139.81 32.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -131.78 142.03 49.64 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.761 -176.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 59.7 mt -124.62 128.99 73.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.249 0.547 . . . . 0.0 110.06 173.166 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -96.26 99.54 11.24 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.53 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.2 t-20 -74.7 106.29 6.19 Favored 'General case' 0 C--N 1.331 -0.209 0 O-C-N 123.647 0.592 . . . . 0.0 110.933 -175.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 71.2 mtm180 -73.16 -43.91 60.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.588 -170.608 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 29.8 mt -72.56 -45.09 60.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.634 -174.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 37.2 t-20 -95.13 -3.11 48.57 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -174.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 73.0 p 50.73 42.9 28.0 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.478 0.656 . . . . 0.0 111.186 177.088 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.0 m -125.43 133.87 52.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.275 -179.349 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 80.4 p -80.16 130.45 35.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.301 -178.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -118.46 122.22 42.19 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 174.469 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 34.6 t -125.48 145.62 32.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-O 120.725 0.298 . . . . 0.0 110.674 -177.433 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -148.26 126.41 5.93 Favored Pre-proline 0 CA--C 1.538 0.492 0 CA-C-O 118.64 -0.695 . . . . 0.0 110.496 174.171 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -75.42 150.9 37.02 Favored 'Trans proline' 0 N--CA 1.5 1.875 0 C-N-CA 121.462 1.442 . . . . 0.0 112.184 177.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.4 HD12 ' HB3' ' A' ' 63' ' ' HIS . 66.5 mt -92.15 133.09 34.69 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.31 178.257 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.6 p -132.21 159.54 38.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.732 177.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -94.54 36.69 3.67 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.96 -178.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 51.7 p -111.07 -22.49 11.44 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 174.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.84 145.04 54.07 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-O 120.878 0.37 . . . . 0.0 111.251 -176.062 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 57.5 tt0 -116.93 135.78 53.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.729 175.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 63.2 mt -113.28 159.19 19.62 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.702 -176.418 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -150.02 143.94 25.49 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 178.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 29.3 t -99.59 109.15 21.68 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.462 -0.495 . . . . 0.0 110.326 178.081 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.404 ' HG3' HD22 ' A' ' 94' ' ' LEU . 19.3 mm-40 -106.83 103.75 48.55 Favored Pre-proline 0 C--N 1.329 -0.317 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 172.638 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -67.38 142.37 59.68 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 CA-C-N 120.491 1.211 . . . . 0.0 111.787 -172.138 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -90.76 12.73 55.38 Favored 'Cis proline' 0 N--CA 1.5 1.899 0 CA-C-N 121.146 1.445 . . . . 0.0 113.493 -4.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -94.9 170.17 9.62 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 122.304 0.242 . . . . 0.0 110.618 -176.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 58.0 tp -111.99 134.91 53.25 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 171.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.441 HD21 ' HZ2' ' B' 1345 ' ' TRP . 10.6 tp -126.88 139.65 52.92 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.5 0.191 . . . . 0.0 110.606 -173.395 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 50.9 p90 -145.5 156.81 43.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.798 0.332 . . . . 0.0 110.534 175.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.8 mtm105 -102.07 146.89 27.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.66 -178.368 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -126.47 163.81 22.52 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.591 0.71 . . . . 0.0 111.374 -177.188 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -47.16 144.86 2.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.192 -177.526 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 31.9 ttt85 65.27 30.92 11.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.416 -0.811 . . . . 0.0 112.021 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.5 p 65.59 35.24 7.22 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.871 0.367 . . . . 0.0 111.719 166.138 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 91.7 mtt-85 -98.0 152.74 18.95 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.363 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 78.3 mt -114.58 127.58 72.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -177.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -137.56 150.32 47.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.675 178.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.06 169.3 25.03 Favored Glycine 0 CA--C 1.522 0.53 0 N-CA-C 111.346 -0.702 . . . . 0.0 111.346 -176.262 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -125.3 139.78 53.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.902 0.382 . . . . 0.0 110.894 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 66.5 t90 -107.1 121.57 44.75 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.574 174.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.439 ' CD1' HG22 ' A' ' 31' ' ' VAL . 61.2 m-85 -111.74 140.19 46.58 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.131 0.269 . . . . 0.0 110.461 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -49.93 -37.72 33.03 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.793 178.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 46.3 t-20 -134.76 131.43 37.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.107 178.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.4 p -57.14 -38.24 73.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.884 -179.192 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -57.81 -44.84 86.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.524 0.678 . . . . 0.0 109.962 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -57.28 -45.28 84.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.026 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 47.5 t -59.3 -39.59 83.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.612 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -60.07 -46.26 90.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.908 0.385 . . . . 0.0 110.705 -177.208 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -59.96 -48.96 79.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.652 -177.407 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.673 HG23 HD11 ' A' ' 54' ' ' ILE . 31.7 mm -58.62 -44.74 90.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.037 -178.581 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 57.6 p -59.46 -43.82 93.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.739 -177.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.78 -44.74 94.08 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.687 -0.965 . . . . 0.0 110.687 -178.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.504 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.1 mt -58.32 -47.64 83.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.115 0.483 . . . . 0.0 110.501 -178.505 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 51.7 t -59.15 -43.41 89.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.137 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -57.25 -41.95 80.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.907 0.384 . . . . 0.0 110.673 -178.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.55 -46.27 94.64 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 -179.513 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 72.4 mt -58.55 -42.62 88.29 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.943 0.401 . . . . 0.0 110.662 -179.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 48.1 mt -60.28 -40.39 90.27 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.82 -179.086 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 25.1 pttt -88.53 3.2 51.12 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 49.9 m -120.66 143.27 48.8 Favored 'General case' 0 C--O 1.231 0.116 0 O-C-N 122.021 -0.424 . . . . 0.0 110.42 179.513 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 59.4 mttp . . . . . 0 C--O 1.22 -0.45 0 CA-C-O 117.914 -1.041 . . . . 0.0 110.511 -179.837 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.277 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -49.59 148.18 12.01 Favored 'Trans proline' 0 N--CA 1.496 1.664 0 CA-C-N 118.861 1.33 . . . . 0.0 112.001 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 97.4 mm-40 -99.08 143.04 29.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.563 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -67.38 153.83 94.08 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.547 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -70.03 -33.77 14.94 Favored 'Trans proline' 0 N--CA 1.494 1.546 0 C-N-CA 121.32 1.347 . . . . 0.0 112.057 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 78.7 mt -62.29 -40.34 95.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.743 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.3 mt -100.11 122.98 43.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.551 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -144.66 -44.91 0.24 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.482 179.369 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -59.42 -37.91 79.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.072 -179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -56.99 147.41 24.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.828 0.347 . . . . 0.0 110.747 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 38.3 ptt85 -71.43 133.07 45.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.935 -179.357 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.62 160.53 26.89 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.469 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -50.09 136.63 37.55 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 121.322 1.348 . . . . 0.0 111.751 179.131 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -103.21 150.03 37.52 Favored Pre-proline 0 C--O 1.236 0.356 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.779 -178.352 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 30.1 Cg_exo -57.9 128.96 30.98 Favored 'Trans proline' 0 N--CA 1.496 1.637 0 C-N-CA 121.032 1.155 . . . . 0.0 111.698 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 74.92 25.07 70.21 Favored Glycine 0 CA--C 1.531 1.057 0 CA-C-N 116.09 -0.504 . . . . 0.0 112.617 177.179 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 25.9 pt20 -52.02 150.31 4.43 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 117.762 0.781 . . . . 0.0 111.292 175.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 7.2 ttt -61.17 138.95 94.5 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-O 119.03 -0.509 . . . . 0.0 110.531 -175.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -76.3 160.88 35.52 Favored 'Trans proline' 0 N--CA 1.495 1.575 0 C-N-CA 121.396 1.397 . . . . 0.0 111.878 177.172 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -101.96 109.26 20.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.504 178.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1338 ' ' LEU . . . . . 0.428 HD12 ' CB ' ' A' ' 43' ' ' TRP . 13.5 mt -64.16 151.6 89.96 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.329 -0.396 . . . . 0.0 109.954 179.549 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -79.11 139.86 15.35 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 C-N-CA 121.229 1.286 . . . . 0.0 111.339 175.619 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 27.5 mmtp -97.13 125.76 44.69 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 118.889 -0.577 . . . . 0.0 110.225 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -74.09 155.72 47.33 Favored 'Trans proline' 0 N--CA 1.495 1.613 0 C-N-CA 121.429 1.419 . . . . 0.0 111.704 172.292 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -51.73 154.76 8.91 Favored 'Trans proline' 0 N--CA 1.494 1.554 0 C-N-CA 121.361 1.374 . . . . 0.0 111.783 178.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 26.0 tp -49.91 -29.17 7.76 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -177.241 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 64.7 t80 -54.93 -37.12 66.0 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.898 0.38 . . . . 0.0 111.228 -176.642 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1345 ' ' TRP . . . . . 0.441 ' HZ2' HD21 ' A' ' 94' ' ' LEU . 34.2 t90 -60.55 -48.14 83.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.261 -177.006 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -62.58 -48.8 77.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.119 0.485 . . . . 0.0 110.57 -177.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -59.2 -42.62 91.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.938 -176.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -59.12 -48.52 81.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.861 0.362 . . . . 0.0 110.594 -176.457 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.63 -48.94 79.71 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.601 -177.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -59.64 -41.6 90.85 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.174 -176.505 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 48.7 tptt -64.01 -47.42 80.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.093 -177.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -55.24 -48.92 73.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.204 -178.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -65.04 -35.24 80.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.501 179.749 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -85.72 125.41 33.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.843 0.354 . . . . 0.0 110.895 -178.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 5.7 mp . . . . . 0 C--O 1.221 -0.445 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.469 179.491 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.344 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_exo -48.82 149.47 7.61 Favored 'Trans proline' 0 N--CA 1.497 1.706 0 C-N-CA 121.323 1.349 . . . . 0.0 112.168 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -91.49 10.01 29.54 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 43.9 ttm -84.55 119.52 25.28 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-N 118.037 0.38 . . . . 0.0 110.576 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -94.27 103.2 15.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.63 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 23.5 p-10 -64.83 -38.62 91.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.03 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 20.7 tp -56.55 -40.07 74.49 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.781 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.0 ttm -91.88 124.55 36.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.599 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.21 144.48 55.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.473 179.455 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.0 p30 -168.83 -175.1 2.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.821 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -59.94 -32.77 71.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.54 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.5 m -55.85 -39.57 71.62 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.899 0.38 . . . . 0.0 110.768 -178.042 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mm -60.29 -47.08 93.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.991 0.424 . . . . 0.0 110.051 -178.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 35.3 m -58.98 -44.62 91.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.448 -177.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -59.22 -45.0 92.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.608 -178.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 44.1 ttm -58.34 -44.01 88.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.025 0.44 . . . . 0.0 110.319 -178.002 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 29.7 m120 -60.13 -49.62 76.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.271 -178.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.698 ' HA ' HD12 ' A' ' 14' ' ' ILE . 10.8 tp -59.62 -33.25 71.27 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.066 -178.84 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.04 -50.35 70.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.632 0.254 . . . . 0.0 110.798 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.04 -41.77 83.97 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.018 0.437 . . . . 0.0 110.455 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.698 HD12 ' HA ' ' A' ' 11' ' ' LEU . 94.9 mt -54.16 -52.96 32.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.66 178.406 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -52.51 -23.69 6.7 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -178.704 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.1 tttm -59.0 -33.65 70.95 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 -177.372 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.9 mm -109.89 -42.9 5.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.942 0.401 . . . . 0.0 110.204 -177.293 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -116.85 80.07 10.66 Favored Pre-proline 0 CA--C 1.535 0.375 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.341 -176.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -54.2 -22.59 26.43 Favored 'Trans proline' 0 N--CA 1.498 1.741 0 C-N-CA 121.533 1.489 . . . . 0.0 113.379 -176.129 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -92.1 14.42 16.04 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 -174.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -91.78 121.46 33.43 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 173.676 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.622 ' O ' HD21 ' A' ' 11' ' ' LEU . 22.9 tptm -104.37 -39.83 6.31 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.135 -172.794 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -134.31 147.72 50.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.099 -176.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.415 HD11 HD12 ' A' ' 14' ' ' ILE . 22.6 mt -99.6 133.25 43.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 172.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.8 t -92.48 -47.25 14.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.983 179.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.5 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.0 t0 -153.07 151.15 29.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.84 178.331 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.1 p -139.02 132.04 29.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.059 0.457 . . . . 0.0 110.925 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.6 t -106.28 125.83 51.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.63 176.623 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.7 m -54.04 -37.85 64.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.241 -173.042 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 64.6 t-80 -151.52 126.94 10.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.331 0.586 . . . . 0.0 111.737 -179.138 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.41 HG21 ' HB3' ' A' ' 52' ' ' PHE . 94.8 t -144.97 140.83 23.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.399 -178.128 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.48 149.92 51.05 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.211 -177.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -98.32 131.96 44.19 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.35 0.595 . . . . 0.0 111.889 -176.046 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -124.58 143.18 50.84 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.6 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 86.1 m -121.94 144.76 48.68 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -106.5 131.96 53.07 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.881 0.372 . . . . 0.0 110.116 175.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 -103.62 115.05 29.79 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.828 177.081 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.7 t -67.93 -32.56 73.1 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.958 -176.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.4 m -60.29 -39.06 85.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.663 0.268 . . . . 0.0 110.996 -177.363 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -95.82 -21.46 18.09 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 69.71 44.37 0.87 Allowed 'General case' 0 C--O 1.232 0.181 0 CA-C-O 121.402 0.62 . . . . 0.0 109.697 -178.02 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -150.4 162.68 40.09 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.143 -177.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.413 ' CB ' HD12 ' B' 1338 ' ' LEU . 85.3 m95 -94.94 140.08 30.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.403 178.24 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -122.26 130.33 53.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.076 177.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.9 pttp -75.43 139.27 42.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.293 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.7 p -92.33 169.4 10.61 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.651 -0.419 . . . . 0.0 109.95 178.229 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.1 p30 -85.79 13.11 7.73 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 177.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 40.2 t -104.11 106.44 20.32 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-O 121.025 0.441 . . . . 0.0 110.313 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -130.76 114.59 15.54 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 176.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -161.94 176.47 38.38 Favored Glycine 0 CA--C 1.519 0.338 0 C-N-CA 120.099 -1.048 . . . . 0.0 112.451 -169.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.517 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -79.71 136.28 36.74 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 175.398 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.41 ' HB3' HG21 ' A' ' 31' ' ' VAL . 4.8 t80 -101.44 123.5 45.6 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 120.952 -0.299 . . . . 0.0 110.23 -176.34 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.517 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 5.0 m-85 -128.25 141.16 51.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.629 0.252 . . . . 0.0 110.658 177.057 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.425 HD11 HG23 ' A' ' 116' ' ' ILE . 74.6 mt -101.5 127.06 55.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 171.325 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.627 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 12.3 m-30 -108.55 138.94 44.03 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.956 0.408 . . . . 0.0 111.346 -177.393 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 61.5 t60 -108.81 143.38 38.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.912 174.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 64.3 ttt180 -140.47 145.85 37.46 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.025 177.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.9 m120 -86.97 28.18 0.94 Allowed 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.268 -0.423 . . . . 0.0 112.045 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.31 166.09 33.17 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 179.274 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -64.05 127.91 92.4 Favored Pre-proline 0 CA--C 1.54 0.574 0 CA-C-O 118.463 -0.779 . . . . 0.0 109.949 -177.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -75.66 140.98 69.52 Favored 'Cis proline' 0 N--CA 1.497 1.702 0 CA-C-N 121.835 1.691 . . . . 0.0 111.741 -1.204 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -62.73 -41.87 99.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.955 -177.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.403 ' HB3' HD12 ' A' ' 80' ' ' ILE . 73.5 m80 -143.25 139.55 30.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.359 0.6 . . . . 0.0 110.908 -177.079 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.4 t -149.99 151.76 33.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.345 -178.044 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 51.7 mt -114.68 138.92 43.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 -177.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -131.82 142.16 49.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.391 -178.043 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.5 mt -121.07 129.63 75.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.248 0.547 . . . . 0.0 109.738 172.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -97.21 99.54 11.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.492 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -73.31 106.06 4.97 Favored 'General case' 0 C--N 1.332 -0.188 0 O-C-N 123.702 0.626 . . . . 0.0 111.013 -175.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.2 ttm180 -72.85 -43.39 62.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.416 -171.114 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 52.6 mt -70.3 -45.25 66.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.605 -174.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 39.0 m-20 -95.1 -3.17 48.57 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -175.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 67.4 p 51.63 43.15 30.01 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.55 0.69 . . . . 0.0 110.996 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.1 m -124.85 142.02 51.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.277 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.3 p -88.58 133.66 34.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.389 -178.172 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -123.69 122.09 37.19 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 175.3 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.8 p -125.57 147.34 30.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 120.836 0.35 . . . . 0.0 111.109 -178.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -149.8 126.49 5.31 Favored Pre-proline 0 CA--C 1.539 0.534 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.203 175.214 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -75.39 150.91 37.17 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 121.371 1.38 . . . . 0.0 112.067 178.082 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.403 HD12 ' HB3' ' A' ' 63' ' ' HIS . 64.9 mt -89.78 115.81 30.03 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.328 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 66.0 p -97.92 159.01 15.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.94 176.643 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -95.4 24.96 26.79 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.817 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.3 p -111.07 -10.9 14.33 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 175.196 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.0 mt -67.96 135.16 51.94 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.856 0.36 . . . . 0.0 111.423 -175.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -111.05 135.92 50.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.768 175.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 66.6 mt -113.91 161.15 17.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.998 0.428 . . . . 0.0 111.056 -175.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -150.04 140.93 22.82 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 177.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.2 t -102.27 109.2 20.81 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.582 -0.447 . . . . 0.0 111.046 -178.722 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -106.82 103.75 48.52 Favored Pre-proline 0 C--N 1.329 -0.301 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 170.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -69.56 141.85 47.16 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 CA-C-N 120.654 1.269 . . . . 0.0 111.811 -172.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -90.08 11.94 57.5 Favored 'Cis proline' 0 N--CA 1.499 1.816 0 CA-C-N 121.068 1.417 . . . . 0.0 113.628 -3.453 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -90.86 169.54 10.84 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.686 0.279 . . . . 0.0 110.765 -178.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 50.7 tp -118.77 134.66 54.98 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 171.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.434 HD11 ' CG2' ' A' ' 102' ' ' ILE . 9.3 tp -125.58 140.37 52.79 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.637 0.256 . . . . 0.0 110.426 -175.441 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 22.2 p90 -145.42 155.09 42.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.787 0.327 . . . . 0.0 110.239 175.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.1 mtm105 -101.98 147.75 26.18 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.877 0.37 . . . . 0.0 110.624 -177.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -128.85 165.65 20.58 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.731 0.777 . . . . 0.0 111.523 -176.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -47.11 146.93 1.6 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.553 -0.748 . . . . 0.0 112.285 -177.378 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 63.33 30.92 15.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.227 179.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.5 p 66.26 35.25 6.05 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.729 0.3 . . . . 0.0 111.685 166.174 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -98.87 152.78 19.37 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.829 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.434 ' CG2' HD11 ' A' ' 94' ' ' LEU . 86.5 mt -115.46 126.96 73.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -178.15 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -133.92 150.24 51.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.58 178.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.6 167.38 25.89 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 111.351 -0.7 . . . . 0.0 111.351 -176.218 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -125.38 139.53 53.59 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.517 -0.341 . . . . 0.0 110.663 -179.098 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 7.6 t90 -107.16 125.72 51.46 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.417 174.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -113.52 141.8 46.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.792 0.329 . . . . 0.0 110.625 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -51.43 -35.32 38.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.691 178.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.2 t-20 -137.38 136.75 38.17 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.755 0.312 . . . . 0.0 110.403 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 25.1 m -61.38 -42.56 98.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.107 -177.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -57.84 -43.2 85.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.368 0.604 . . . . 0.0 110.106 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -57.03 -45.9 82.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.869 178.58 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 43.0 t -59.6 -37.74 79.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.889 178.623 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -61.73 -50.08 73.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.656 0.265 . . . . 0.0 110.856 -175.741 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -61.65 -44.75 96.38 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.987 -176.429 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.496 ' HA ' HD12 ' A' ' 119' ' ' LEU . 23.1 mm -59.52 -46.86 92.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 19.3 m -58.55 -44.62 89.71 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.563 -177.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.39 -43.33 93.91 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 -178.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.5 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.7 mt -58.25 -49.45 77.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.143 0.497 . . . . 0.0 110.489 -178.705 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 54.5 t -58.8 -43.87 89.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.171 -177.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -59.05 -42.3 89.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.825 -178.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.94 -41.94 99.7 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 111.407 -0.677 . . . . 0.0 111.407 -178.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 20.8 mt -63.67 -43.54 96.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.788 0.328 . . . . 0.0 111.181 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 66.9 mt -63.05 -44.88 94.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.437 -176.483 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 33.0 pttt -71.65 -37.52 70.81 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.754 -0.378 . . . . 0.0 111.28 -177.341 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 71.2 p -89.75 159.87 16.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.912 0.387 . . . . 0.0 110.519 -179.174 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 67.7 tttt . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 117.968 -1.015 . . . . 0.0 110.548 179.889 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.39 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -69.38 144.53 56.36 Favored 'Trans proline' 0 N--CA 1.495 1.592 0 C-N-CA 121.296 1.331 . . . . 0.0 111.97 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -101.44 152.31 20.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.625 -179.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 14.9 p30 -67.01 155.46 90.18 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.64 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -78.38 -0.94 11.16 Favored 'Trans proline' 0 N--CA 1.496 1.649 0 C-N-CA 121.331 1.354 . . . . 0.0 113.882 -179.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 21.4 tp -56.73 -42.01 78.47 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.825 0.345 . . . . 0.0 110.554 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 27.8 tp -64.74 -39.08 93.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.899 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 98.3 mm-40 -60.0 131.5 51.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.835 0.35 . . . . 0.0 110.748 -179.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.83 -39.23 93.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.891 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -56.94 145.85 28.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.862 0.363 . . . . 0.0 110.7 -179.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 68.4 ttt180 -74.62 137.85 42.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.491 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -71.92 157.06 90.24 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.695 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -68.26 133.19 27.78 Favored 'Trans proline' 0 N--CA 1.496 1.672 0 C-N-CA 121.272 1.315 . . . . 0.0 111.919 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 47.7 t80 -104.06 140.19 20.83 Favored Pre-proline 0 CA--C 1.532 0.272 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.909 -179.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -57.92 128.95 30.92 Favored 'Trans proline' 0 N--CA 1.497 1.705 0 C-N-CA 121.053 1.169 . . . . 0.0 111.558 -179.635 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 103.42 -5.2 48.28 Favored Glycine 0 CA--C 1.535 1.316 0 CA-C-O 119.509 -0.606 . . . . 0.0 113.348 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -77.23 137.61 38.93 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 118.324 1.062 . . . . 0.0 110.225 176.226 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 4.3 ttp -68.44 133.65 91.03 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-O 118.717 -0.659 . . . . 0.0 110.003 -178.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -56.16 144.06 82.12 Favored 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 121.133 1.222 . . . . 0.0 111.506 175.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -99.14 101.22 12.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.608 -179.682 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1338 ' ' LEU . . . . . 0.413 HD12 ' CB ' ' A' ' 43' ' ' TRP . 16.1 mt -66.72 147.1 99.12 Favored Pre-proline 0 C--N 1.329 -0.288 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 179.126 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -79.14 139.82 15.26 Favored 'Trans proline' 0 N--CA 1.491 1.351 0 C-N-CA 121.166 1.244 . . . . 0.0 111.215 174.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -97.2 125.78 44.46 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-O 118.796 -0.621 . . . . 0.0 109.861 178.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -75.09 163.43 35.15 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 121.425 1.417 . . . . 0.0 111.694 173.008 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.56 157.2 32.9 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 121.341 1.36 . . . . 0.0 111.341 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 26.4 tp -50.06 -27.61 5.85 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -176.486 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -54.61 -36.7 64.74 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.867 0.365 . . . . 0.0 111.294 -177.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 39.2 t90 -61.08 -48.13 83.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.247 -177.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -61.2 -46.35 90.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.051 0.453 . . . . 0.0 110.477 -178.27 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -59.35 -44.71 92.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.722 -177.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -58.28 -46.33 86.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.451 -176.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.07 -47.74 84.6 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.631 -178.281 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -58.33 -41.65 85.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.951 -177.123 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 23.2 tptm -64.42 -48.19 76.29 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.995 -178.041 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -54.92 -46.43 74.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.152 -178.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 42.8 tp10 -64.9 -37.01 86.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.076 178.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -63.99 148.82 48.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.76 0.314 . . . . 0.0 110.607 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 78.1 mt . . . . . 0 C--O 1.22 -0.485 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.554 179.958 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.252 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.1 -32.32 48.77 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 CA-C-N 118.854 1.327 . . . . 0.0 112.167 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 20.1 t-80 -61.29 -51.1 70.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.722 -179.395 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 64.8 mtt -140.82 145.88 36.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.54 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -97.28 141.86 29.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.651 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -140.28 100.19 3.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.425 179.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 79.1 mt -57.37 -43.27 83.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.653 -179.301 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.7 mtm -142.25 159.13 42.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.605 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -63.94 148.24 50.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.489 179.274 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -148.13 161.86 40.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.708 -179.682 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -59.85 -36.55 77.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.192 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.5 p -58.48 -37.86 76.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.756 0.312 . . . . 0.0 110.941 -178.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 43.7 mm -62.29 -40.78 89.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.372 179.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.9 m -63.49 -49.97 71.47 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.679 -176.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.7 ptt180 -61.88 -37.45 84.61 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.799 -178.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 44.0 ttm -58.68 -46.21 87.72 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.151 0.5 . . . . 0.0 110.143 179.252 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -59.67 -48.92 79.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.195 -178.517 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.687 ' HA ' HD12 ' A' ' 14' ' ' ILE . 9.3 tp -59.74 -32.97 71.06 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.651 -0.419 . . . . 0.0 111.177 -178.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.84 -50.53 70.59 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.654 0.264 . . . . 0.0 110.701 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.64 -41.74 86.7 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.43 179.244 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.687 HD12 ' HA ' ' A' ' 11' ' ' LEU . 95.3 mt -54.19 -52.94 33.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.649 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -54.15 -21.6 9.17 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -178.404 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -58.64 -33.96 70.66 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 111.727 0.269 . . . . 0.0 111.727 -178.023 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.699 HG21 ' CB ' ' A' ' 75' ' ' SER . 46.6 mm -113.0 -40.15 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-O 120.722 0.296 . . . . 0.0 110.531 -177.015 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -117.05 77.38 8.99 Favored Pre-proline 0 CA--C 1.535 0.368 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.214 -178.29 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -55.39 -20.71 26.86 Favored 'Trans proline' 0 N--CA 1.498 1.76 0 C-N-CA 121.536 1.49 . . . . 0.0 113.459 -175.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.8 p90 -90.77 9.94 28.04 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -174.417 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -84.62 122.32 28.88 Favored 'General case' 0 C--O 1.231 0.11 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 174.292 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.409 ' O ' HD21 ' A' ' 11' ' ' LEU . 31.4 ttpt -97.49 -40.54 8.61 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.887 -173.841 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -148.44 153.06 38.0 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.586 -0.445 . . . . 0.0 111.433 -178.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 29.9 mt -94.38 138.3 20.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.848 178.353 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.2 t -92.58 -47.17 14.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.839 177.46 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.502 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.9 t0 -152.88 155.06 36.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.019 178.381 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.8 p -141.86 132.02 24.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.044 0.449 . . . . 0.0 110.943 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.5 t -108.49 126.45 52.93 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.647 177.16 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.4 t -54.58 -38.85 67.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.28 -172.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -150.45 126.8 10.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.225 0.536 . . . . 0.0 111.558 -179.079 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.456 HG22 ' CD2' ' A' ' 107' ' ' PHE . 96.2 t -145.19 140.43 22.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.309 -177.672 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.64 149.76 51.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.725 0.298 . . . . 0.0 111.314 -177.661 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.511 ' HD2' HG21 ' A' ' 46' ' ' THR . 36.4 t80 -98.63 130.83 45.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.27 -177.7 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -125.31 142.08 51.71 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.599 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.579 HG23 ' CZ ' ' A' ' 103' ' ' ARG . 64.1 m -120.38 145.86 46.75 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 178.342 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -108.27 131.87 54.26 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 121.011 0.434 . . . . 0.0 110.433 176.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -104.11 115.45 30.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.888 177.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.0 t -67.63 -32.51 73.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.918 -177.307 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.1 t -60.44 -40.26 90.44 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.726 0.298 . . . . 0.0 110.82 -177.15 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 98.0 mm-40 -93.8 -21.36 19.34 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.3 t30 69.66 43.48 0.98 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-O 121.436 0.636 . . . . 0.0 109.803 -177.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -151.51 162.97 40.05 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.037 -177.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.456 ' CB ' HD12 ' B' 1338 ' ' LEU . 89.0 m95 -94.33 141.76 28.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.336 177.507 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -124.01 130.42 52.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 0.0 109.958 176.039 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -72.42 139.21 47.65 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 177.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.511 HG21 ' HD2' ' A' ' 33' ' ' PHE . 77.3 p -92.35 179.04 5.66 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.298 -178.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -88.67 15.17 8.57 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -179.081 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.4 t -111.88 106.42 20.73 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 CA-C-O 120.982 0.42 . . . . 0.0 110.273 178.65 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -132.19 112.93 12.7 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 174.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.52 38.96 Favored Glycine 0 CA--C 1.52 0.4 0 C-N-CA 120.202 -0.999 . . . . 0.0 112.213 -168.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.478 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.47 135.95 37.49 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 174.647 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.419 ' HB3' HG21 ' A' ' 31' ' ' VAL . 6.3 t80 -101.26 127.04 48.03 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.346 -175.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.478 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 6.5 m-85 -130.76 142.09 50.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.765 0.316 . . . . 0.0 110.308 177.143 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.699 HD11 HG23 ' A' ' 116' ' ' ILE . 66.3 mt -101.62 127.58 54.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 172.616 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.672 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.2 m-30 -108.48 137.62 46.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.997 0.427 . . . . 0.0 111.208 -175.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 30.1 t60 -116.7 143.31 45.79 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.967 175.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -141.22 147.43 38.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.141 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -86.9 28.1 0.93 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.275 -0.421 . . . . 0.0 112.125 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.72 160.5 37.97 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 178.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -64.05 131.78 95.08 Favored Pre-proline 0 CA--C 1.539 0.547 0 CA-C-O 118.536 -0.745 . . . . 0.0 110.04 -176.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -71.13 140.88 67.16 Favored 'Cis proline' 0 N--CA 1.498 1.792 0 CA-C-N 121.701 1.643 . . . . 0.0 111.515 -1.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -65.22 -42.73 93.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.028 -177.296 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -143.52 140.97 30.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.494 0.664 . . . . 0.0 111.038 -177.078 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.3 t -150.42 152.39 34.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.211 -178.024 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 46.5 mt -112.58 138.13 42.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -178.371 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 79.2 t80 -131.83 142.02 49.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.972 -176.751 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.0 mt -123.62 133.23 69.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.18 0.514 . . . . 0.0 109.847 172.674 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -99.16 99.55 10.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.37 179.384 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -72.42 106.95 4.74 Favored 'General case' 0 C--N 1.332 -0.193 0 O-C-N 123.666 0.604 . . . . 0.0 111.092 -175.151 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 55.6 ttp180 -72.86 -41.04 65.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.198 -171.583 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 75.5 mt -70.51 -45.16 66.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.684 -175.109 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -95.01 -3.34 48.57 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -175.083 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.43 HG22 ' O ' ' A' ' 73' ' ' THR . 13.0 m 55.87 43.1 28.11 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 121.452 0.644 . . . . 0.0 110.57 177.064 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.6 m -131.78 149.03 52.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.229 -178.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.699 ' CB ' HG21 ' A' ' 17' ' ' ILE . 4.0 p -101.71 141.82 33.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.929 0.395 . . . . 0.0 110.933 -179.087 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -135.45 122.13 20.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.231 178.457 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.8 p -125.49 148.53 30.02 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-O 120.807 0.337 . . . . 0.0 111.035 -177.763 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -147.17 136.27 11.48 Favored Pre-proline 0 CA--C 1.537 0.456 0 CA-C-O 119.03 -0.509 . . . . 0.0 110.487 174.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.51 150.87 36.61 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 121.673 1.582 . . . . 0.0 112.411 179.453 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 68.8 mt -89.96 137.25 21.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.902 0.382 . . . . 0.0 110.165 177.118 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 61.6 p -132.15 159.47 38.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.866 177.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -95.79 36.04 4.03 Favored Glycine 0 CA--C 1.524 0.653 0 C-N-CA 120.845 -0.693 . . . . 0.0 111.914 -178.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.2 t -109.22 -21.97 12.31 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 174.598 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 74.8 mt -68.49 144.93 54.47 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-O 120.949 0.404 . . . . 0.0 111.492 -176.149 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 54.2 tt0 -114.78 135.87 53.71 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.715 175.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 67.6 mt -115.16 158.09 22.72 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.057 0.456 . . . . 0.0 111.11 -175.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -149.54 141.02 23.34 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 177.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.4 t -98.13 109.09 21.9 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.399 -0.521 . . . . 0.0 110.578 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -106.83 103.68 48.22 Favored Pre-proline 0 C--N 1.328 -0.355 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 172.118 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -71.41 142.22 40.41 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 CA-C-N 120.596 1.249 . . . . 0.0 112.025 -171.504 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -90.56 13.72 52.58 Favored 'Cis proline' 0 N--CA 1.499 1.844 0 CA-C-N 121.075 1.42 . . . . 0.0 113.541 -3.752 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -93.04 172.98 7.97 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 122.149 0.179 . . . . 0.0 110.721 -177.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 58.7 tp -115.94 135.7 53.73 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 171.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.2 tp -127.15 139.63 52.83 Favored 'General case' 0 C--N 1.334 -0.096 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 -174.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 9.4 p90 -148.84 153.79 38.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.951 0.405 . . . . 0.0 110.659 176.442 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 31.6 mtm180 -102.43 149.21 24.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.81 -176.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -129.73 166.53 19.68 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.791 0.805 . . . . 0.0 111.464 -177.679 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -47.77 145.01 3.01 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.249 -176.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 65.24 31.01 11.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.093 179.251 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 37.8 t 66.29 35.14 6.06 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.912 0.387 . . . . 0.0 111.578 166.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -98.25 152.77 19.06 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 179.22 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 78.0 mt -115.77 126.28 73.24 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 CA-C-O 121.061 0.458 . . . . 0.0 109.993 -177.122 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.579 ' CZ ' HG23 ' A' ' 35' ' ' THR . 85.7 mmt-85 -127.95 149.4 50.35 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.276 178.123 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -140.54 164.69 26.27 Favored Glycine 0 CA--C 1.522 0.517 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 -178.545 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 32.9 m-85 -125.35 136.65 53.67 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.442 -0.379 . . . . 0.0 110.856 -178.453 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -107.41 126.35 52.38 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.735 175.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.456 ' CD2' HG22 ' A' ' 31' ' ' VAL . 62.8 m-85 -117.84 142.67 47.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.799 0.333 . . . . 0.0 110.51 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -51.15 -34.72 32.37 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.769 178.252 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -137.62 136.92 37.96 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.767 0.318 . . . . 0.0 110.469 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.0 p -61.69 -40.48 95.15 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.161 -177.739 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -59.72 -43.67 94.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.407 0.622 . . . . 0.0 110.095 178.355 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -56.73 -45.32 82.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.979 179.265 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 43.0 t -60.22 -39.69 87.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.728 178.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -59.21 -45.65 90.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.77 0.319 . . . . 0.0 110.562 -176.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -60.62 -49.04 79.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.744 -177.528 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.699 HG23 HD11 ' A' ' 54' ' ' ILE . 31.6 mm -58.46 -44.98 90.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.039 -178.374 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 68.1 p -59.74 -44.37 93.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.767 -177.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.7 -43.79 94.32 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 110.678 -0.969 . . . . 0.0 110.678 -178.739 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.502 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.2 mt -59.06 -48.72 80.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.034 0.445 . . . . 0.0 110.506 -178.323 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.403 HG12 HD11 ' A' ' 124' ' ' LEU . 53.3 t -58.82 -43.24 87.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.168 -178.502 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -57.97 -43.0 86.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.681 -178.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.5 -42.77 99.67 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.407 -0.677 . . . . 0.0 111.407 -178.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 34.4 mt -63.94 -40.74 97.14 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.765 0.317 . . . . 0.0 111.403 -179.615 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.403 HD11 HG12 ' A' ' 120' ' ' VAL . 29.8 mt -62.8 -38.18 89.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.687 -176.616 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 32.7 pttt -84.3 -34.38 23.75 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.875 -175.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 49.2 m -110.68 143.59 40.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.857 0.36 . . . . 0.0 110.936 -177.261 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm . . . . . 0 C--O 1.22 -0.476 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.567 179.819 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -49.05 144.46 15.94 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 121.37 1.38 . . . . 0.0 112.034 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -100.14 144.65 28.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.505 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 21.8 p-10 -70.32 153.42 95.18 Favored Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.6 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -83.33 159.95 15.05 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 121.544 1.496 . . . . 0.0 112.219 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 29.9 tp -56.92 -41.04 77.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.634 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 22.8 tp -101.04 124.53 46.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.51 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 52.7 tp60 -102.27 111.69 24.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.594 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -66.94 -39.85 87.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.888 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -89.7 157.34 18.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.729 -178.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 59.8 ttt85 -84.78 127.15 33.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.582 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.6 159.5 30.64 Favored Pre-proline 0 CA--C 1.532 0.263 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.459 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -68.16 145.12 65.64 Favored 'Trans proline' 0 N--CA 1.496 1.658 0 C-N-CA 121.233 1.289 . . . . 0.0 111.768 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -96.6 152.13 38.38 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.691 -179.173 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -57.98 129.0 31.07 Favored 'Trans proline' 0 N--CA 1.496 1.623 0 C-N-CA 121.093 1.195 . . . . 0.0 111.502 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 98.61 -2.17 58.71 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 121.05 -0.595 . . . . 0.0 113.403 179.126 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -52.02 133.75 32.67 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 118.426 1.113 . . . . 0.0 111.378 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 6.6 ttt -69.5 118.16 59.78 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-O 118.624 -0.703 . . . . 0.0 110.461 -178.364 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -59.28 152.88 57.15 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 C-N-CA 121.14 1.227 . . . . 0.0 111.621 175.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 7.5 p30 -98.59 114.84 27.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.745 -179.389 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1338 ' ' LEU . . . . . 0.456 HD12 ' CB ' ' A' ' 43' ' ' TRP . 15.4 mt -71.19 153.63 94.23 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.123 178.915 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.05 139.96 15.51 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 C-N-CA 121.154 1.236 . . . . 0.0 111.145 174.138 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -97.12 125.83 44.47 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-O 118.782 -0.628 . . . . 0.0 109.97 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -77.79 154.9 30.57 Favored 'Trans proline' 0 N--CA 1.494 1.52 0 C-N-CA 121.415 1.41 . . . . 0.0 111.438 173.353 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -50.54 151.18 10.64 Favored 'Trans proline' 0 N--CA 1.496 1.647 0 C-N-CA 121.263 1.309 . . . . 0.0 111.747 178.667 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 79.5 mt -49.94 -25.83 3.62 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 -177.089 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -55.54 -38.49 69.35 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.904 0.383 . . . . 0.0 111.059 -177.091 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 33.3 t90 -61.81 -48.11 82.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.269 -176.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -61.37 -48.2 82.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.073 0.463 . . . . 0.0 110.532 -177.122 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -59.86 -45.32 92.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 -177.111 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -58.76 -46.45 87.44 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.669 -176.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.53 -48.43 81.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.765 -177.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -59.06 -42.29 89.95 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.104 -176.53 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 48.9 tttm -64.93 -48.1 75.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.139 -177.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 55.5 tp60 -55.01 -47.97 73.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.139 -178.144 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -64.91 -37.08 86.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.095 179.51 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -70.06 153.93 42.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.83 0.347 . . . . 0.0 110.558 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 23.7 tp . . . . . 0 C--O 1.221 -0.44 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.475 179.925 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.267 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -52.38 -30.71 44.46 Favored 'Trans proline' 0 N--CA 1.497 1.712 0 CA-C-N 119.558 1.679 . . . . 0.0 112.304 177.466 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -55.63 -39.81 71.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.944 -179.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 71.5 mtm -82.08 134.07 35.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.663 -179.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -75.23 174.63 9.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.4 179.456 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 26.3 p-10 -71.26 104.78 3.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.305 0.574 . . . . 0.0 110.68 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 28.9 tp -69.09 -39.88 78.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.824 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.2 mmm -75.82 135.0 40.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.479 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.24 172.84 12.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.511 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.32 153.19 27.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.658 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -59.54 -35.97 75.24 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.139 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.8 t -56.57 -40.47 75.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.892 0.377 . . . . 0.0 110.659 -178.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.0 mm -60.09 -45.71 95.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.215 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.2 m -59.24 -45.66 90.57 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.024 0.44 . . . . 0.0 110.509 -177.607 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -59.38 -44.57 92.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.574 -178.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 44.5 ttm -58.26 -43.53 87.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.102 0.477 . . . . 0.0 110.463 -178.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -60.06 -49.5 77.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.299 -178.315 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.751 ' HA ' HD12 ' A' ' 14' ' ' ILE . 13.7 tp -61.32 -30.86 70.76 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.394 -179.144 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.85 -50.17 71.99 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.745 0.307 . . . . 0.0 110.619 178.102 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.44 -41.49 85.24 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.945 0.402 . . . . 0.0 110.392 178.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.751 HD12 ' HA ' ' A' ' 11' ' ' LEU . 95.5 mt -54.22 -52.95 33.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.659 178.771 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -53.3 -24.29 11.29 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -178.542 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -59.87 -33.52 71.93 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -177.319 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.5 mm -108.34 -40.69 4.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.787 0.327 . . . . 0.0 110.532 -176.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -114.78 84.94 10.89 Favored Pre-proline 0 CA--C 1.533 0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.713 -176.198 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -53.51 -22.97 23.33 Favored 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 121.522 1.482 . . . . 0.0 113.194 -178.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.4 p90 -97.98 22.06 9.84 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -175.352 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -101.81 121.23 41.7 Favored 'General case' 0 C--O 1.231 0.105 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 171.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.483 ' O ' HD21 ' A' ' 11' ' ' LEU . 51.1 tptt -110.95 -38.15 5.18 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.761 0.315 . . . . 0.0 111.272 -173.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -130.02 144.82 51.54 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.808 -176.646 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.471 HG13 HD13 ' A' ' 11' ' ' LEU . 59.4 mt -98.7 129.21 49.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.83 173.944 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.1 t -90.46 -47.11 14.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 0.0 109.914 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.494 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -153.37 152.13 30.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.129 178.322 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.7 p -140.82 131.96 26.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.992 0.425 . . . . 0.0 110.775 178.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.9 t -107.02 129.18 54.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.901 177.063 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.3 m -54.41 -38.3 66.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.269 -172.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 -152.41 127.53 9.77 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.323 0.583 . . . . 0.0 111.91 -178.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.469 HG22 ' CD2' ' A' ' 107' ' ' PHE . 98.4 t -145.2 140.69 22.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.466 -178.089 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.41 149.83 50.38 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.159 -178.079 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -97.03 132.78 42.49 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.204 0.526 . . . . 0.0 111.723 -177.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -128.16 142.85 51.06 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.668 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.3 m -121.5 148.09 44.92 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 177.192 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -112.48 131.69 55.45 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-O 120.865 0.364 . . . . 0.0 110.357 177.278 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -102.01 113.78 27.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.775 176.332 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 85.6 p -68.56 -31.02 69.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.074 -177.018 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.2 m -62.6 -38.58 90.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.667 0.27 . . . . 0.0 110.928 -177.721 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -94.68 -21.41 18.79 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -178.646 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 69.58 45.66 0.78 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.463 0.649 . . . . 0.0 109.434 -177.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 -151.89 149.69 29.24 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.233 -177.088 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.458 ' CB ' HD12 ' B' 1338 ' ' LEU . 82.7 m95 -86.98 142.46 27.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.199 176.57 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -123.78 126.29 46.21 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 175.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -75.51 140.35 42.73 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 178.574 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.8 p -92.29 170.72 9.57 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.144 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -84.37 12.43 6.77 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 178.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 40.4 t -104.39 106.48 20.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-O 120.969 0.414 . . . . 0.0 110.215 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -130.7 116.1 17.57 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 176.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.55 176.39 38.89 Favored Glycine 0 CA--C 1.521 0.443 0 C-N-CA 120.081 -1.056 . . . . 0.0 112.441 -169.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.476 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -80.22 136.63 36.51 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 175.254 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.401 ' HB3' HG21 ' A' ' 31' ' ' VAL . 4.5 t80 -101.8 125.31 48.44 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.293 -175.37 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.476 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 4.9 m-85 -129.46 141.57 50.99 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.791 0.329 . . . . 0.0 110.712 177.015 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.614 HD11 HG23 ' A' ' 116' ' ' ILE . 67.9 mt -101.58 126.38 55.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 171.806 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.654 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 11.6 m-30 -108.57 138.05 45.51 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.892 0.377 . . . . 0.0 111.335 -177.261 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 61.9 t60 -111.6 143.25 42.78 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.871 173.49 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 13.4 tpt180 -142.22 147.71 36.97 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.884 177.206 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -86.9 28.18 0.93 Allowed 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.73 171.3 20.33 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.1 mp0 -63.99 124.38 85.01 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.003 -178.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -79.41 140.97 59.01 Favored 'Cis proline' 0 N--CA 1.497 1.685 0 CA-C-N 121.937 1.728 . . . . 0.0 111.926 -0.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -63.2 -44.26 95.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.941 -177.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -143.32 135.86 27.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.307 0.575 . . . . 0.0 110.837 -177.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.4 t -149.6 150.91 32.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.572 -177.305 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.466 HG13 HD11 ' A' ' 80' ' ' ILE . 57.7 mt -114.32 137.46 47.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 -178.255 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -131.94 142.16 49.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.581 -177.373 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.5 mt -120.05 129.41 75.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.247 0.546 . . . . 0.0 109.729 172.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -96.58 99.52 11.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.531 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.2 t-20 -71.23 105.45 3.45 Favored 'General case' 0 N--CA 1.462 0.151 0 O-C-N 123.642 0.589 . . . . 0.0 110.971 -175.66 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -73.1 -42.43 62.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.235 -171.052 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 60.4 mt -70.9 -45.21 64.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.624 -174.526 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 54.8 m-20 -95.11 -3.27 48.36 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -175.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.0 m 55.71 43.52 27.83 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 121.452 0.644 . . . . 0.0 110.452 177.646 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.6 m -125.16 148.87 48.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.52 -178.204 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.3 p -97.3 132.53 42.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.346 -179.498 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -123.59 122.1 37.29 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.8 p -125.54 147.68 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-O 120.751 0.31 . . . . 0.0 111.237 -178.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -149.77 126.55 5.34 Favored Pre-proline 0 CA--C 1.537 0.473 0 CA-C-O 118.665 -0.684 . . . . 0.0 110.213 174.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -75.27 150.94 37.71 Favored 'Trans proline' 0 N--CA 1.498 1.765 0 C-N-CA 121.46 1.44 . . . . 0.0 112.265 178.161 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.466 HD11 HG13 ' A' ' 65' ' ' ILE . 67.0 mt -90.65 138.92 18.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.929 0.395 . . . . 0.0 110.302 178.546 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.4 p -132.1 155.65 47.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.706 177.118 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -94.04 36.68 3.65 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.002 -178.411 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.9 m -111.12 -22.97 11.17 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 173.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.7 mt -69.13 146.44 52.51 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 120.898 0.38 . . . . 0.0 111.373 -176.07 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.3 tt0 -115.78 135.93 53.54 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.662 175.499 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.1 mt -112.03 158.58 19.38 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.07 0.462 . . . . 0.0 111.058 -176.366 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -147.87 140.22 24.4 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.957 -0.756 . . . . 0.0 108.957 177.003 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.1 t -106.94 109.34 21.21 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.386 -177.522 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -106.83 103.68 48.25 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 169.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.1 145.25 78.48 Favored 'Trans proline' 0 N--CA 1.498 1.779 0 CA-C-N 120.391 1.175 . . . . 0.0 112.037 -170.061 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -92.61 17.53 41.6 Favored 'Cis proline' 0 N--CA 1.499 1.84 0 CA-C-N 120.893 1.355 . . . . 0.0 113.346 -3.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -104.89 162.11 13.61 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 110.337 -0.246 . . . . 0.0 110.337 -177.042 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 32.8 tp -115.72 133.48 55.99 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 122.062 -0.399 . . . . 0.0 111.177 -179.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.47 HD11 ' CG2' ' A' ' 102' ' ' ILE . 9.5 tp -122.53 140.42 52.79 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.252 -175.086 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -142.89 154.96 44.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.768 0.318 . . . . 0.0 110.492 176.542 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.8 mtm105 -101.96 146.65 27.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.71 -178.209 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -127.14 163.4 23.9 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.668 0.746 . . . . 0.0 111.414 -177.092 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 31.6 mp0 -48.33 147.17 2.44 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.112 -177.062 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 64.31 30.96 13.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.118 -0.946 . . . . 0.0 112.176 179.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 48.9 m 67.29 35.24 4.48 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.901 0.381 . . . . 0.0 111.631 165.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -99.82 151.36 21.37 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 178.555 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.575 HD13 ' CH2' ' B' 1345 ' ' TRP . 76.4 mt -114.71 126.51 72.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -178.504 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -137.21 149.72 47.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.13 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -147.39 169.42 28.34 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.001 -175.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -125.16 136.81 53.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.364 -0.418 . . . . 0.0 110.415 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 46.2 t90 -104.47 125.17 50.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.509 176.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.469 ' CD2' HG22 ' A' ' 31' ' ' VAL . 77.4 m-85 -112.22 140.91 46.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.733 -177.607 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -51.49 -40.78 60.21 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.81 179.154 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -129.06 136.55 50.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.671 0.272 . . . . 0.0 110.462 -179.481 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.2 p -63.14 -41.52 99.3 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.309 -177.571 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -60.38 -44.81 95.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.514 0.673 . . . . 0.0 109.985 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -55.98 -43.48 77.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.206 178.206 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 51.6 t -59.35 -41.46 89.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.527 177.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -58.65 -44.59 90.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.618 -176.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -60.56 -49.33 77.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.748 -177.606 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.614 HG23 HD11 ' A' ' 54' ' ' ILE . 30.4 mm -58.29 -45.91 89.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.099 0.476 . . . . 0.0 110.077 -178.109 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 78.0 p -59.99 -43.5 95.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.702 -177.505 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.66 -43.27 94.44 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.68 -0.968 . . . . 0.0 110.68 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.494 HD13 ' HB2' ' A' ' 26' ' ' ASP . 10.6 mt -59.83 -49.8 76.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.017 0.436 . . . . 0.0 110.686 -178.036 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 59.0 t -59.01 -42.67 86.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.148 -178.325 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -58.45 -43.03 88.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.861 0.362 . . . . 0.0 110.639 -178.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.25 -40.58 98.78 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.335 -0.706 . . . . 0.0 111.335 -179.103 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 34.8 mt -63.08 -42.97 99.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.794 0.33 . . . . 0.0 111.077 178.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 40.5 mt -63.17 -44.85 94.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.435 -177.061 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 12.6 pttp -73.07 -34.44 66.24 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.831 -0.348 . . . . 0.0 111.743 -176.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 28.6 t -93.94 145.6 24.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.881 0.372 . . . . 0.0 110.698 -178.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 57.4 tttp . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.498 179.858 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.411 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -50.71 141.92 33.54 Favored 'Trans proline' 0 N--CA 1.495 1.573 0 C-N-CA 121.328 1.352 . . . . 0.0 112.032 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -121.94 147.26 46.25 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.396 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -67.63 157.74 85.1 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.424 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -71.16 -50.01 0.34 Allowed 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 121.257 1.304 . . . . 0.0 112.273 -178.352 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 94.6 mt -141.26 -68.53 0.39 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.669 -179.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.3 mt -98.45 152.42 19.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.728 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -134.67 148.59 50.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.499 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 98.1 mm-40 -93.59 -65.64 0.98 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.638 -179.673 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -135.64 157.36 47.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.594 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 49.9 ttt180 -98.57 132.11 44.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.439 179.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -95.3 154.11 39.5 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.666 -179.469 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -80.91 161.96 20.97 Favored 'Trans proline' 0 N--CA 1.492 1.422 0 C-N-CA 121.517 1.478 . . . . 0.0 111.961 179.549 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 27.6 p90 -131.23 155.97 80.78 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.496 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -57.77 128.88 30.82 Favored 'Trans proline' 0 N--CA 1.495 1.561 0 C-N-CA 121.136 1.224 . . . . 0.0 111.587 -179.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 102.2 -4.99 52.23 Favored Glycine 0 CA--C 1.534 1.269 0 CA-C-O 119.646 -0.53 . . . . 0.0 113.439 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -56.89 134.5 55.49 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 118.279 1.039 . . . . 0.0 110.437 177.267 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 6.0 ttt -75.39 135.03 72.78 Favored Pre-proline 0 CA--C 1.535 0.402 0 CA-C-O 118.699 -0.667 . . . . 0.0 110.326 -177.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -65.95 153.49 77.89 Favored 'Trans proline' 0 N--CA 1.496 1.669 0 C-N-CA 121.183 1.256 . . . . 0.0 111.684 175.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -104.96 110.25 22.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.426 178.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1338 ' ' LEU . . . . . 0.458 HD12 ' CB ' ' A' ' 43' ' ' TRP . 13.9 mt -71.65 151.73 93.58 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.023 -179.64 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -79.14 139.9 15.32 Favored 'Trans proline' 0 N--CA 1.491 1.361 0 C-N-CA 121.182 1.255 . . . . 0.0 111.221 174.365 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -97.06 125.77 44.78 Favored Pre-proline 0 CA--C 1.534 0.363 0 CA-C-O 118.721 -0.657 . . . . 0.0 109.997 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -72.57 155.43 54.76 Favored 'Trans proline' 0 N--CA 1.496 1.664 0 C-N-CA 121.383 1.389 . . . . 0.0 111.681 173.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.05 157.0 6.63 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 121.31 1.34 . . . . 0.0 111.613 178.268 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.3 tp -49.9 -29.94 9.18 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -177.048 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 56.8 t80 -55.15 -37.7 67.3 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.833 0.349 . . . . 0.0 111.207 -177.01 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1345 ' ' TRP . . . . . 0.575 ' CH2' HD13 ' A' ' 102' ' ' ILE . 20.3 t90 -61.11 -48.14 83.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.256 -177.059 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -62.02 -47.83 83.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.007 0.432 . . . . 0.0 110.531 -177.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -59.33 -44.59 92.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.838 -177.155 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -58.99 -46.59 87.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.699 -176.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.09 -47.88 84.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.721 -177.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -59.02 -42.74 90.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.006 -176.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 63.0 tttm -64.29 -47.17 80.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.096 -177.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -54.93 -47.36 74.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.075 -178.374 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 42.4 tp10 -64.91 -36.98 86.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.114 178.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -63.34 150.42 43.44 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.824 0.345 . . . . 0.0 110.56 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 25.9 tp . . . . . 0 C--O 1.22 -0.494 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.552 -179.967 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.358 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -65.28 139.95 62.25 Favored 'Trans proline' 0 N--CA 1.497 1.683 0 CA-C-N 119.319 1.56 . . . . 0.0 111.961 -175.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -56.95 -40.94 77.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.759 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 85.5 mtp -89.62 158.08 17.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.681 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -140.75 156.46 46.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.564 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 76.0 m-20 -61.55 166.88 3.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.611 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 29.1 tp -55.95 -40.2 72.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.81 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.0 mmm -84.6 124.66 31.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.273 179.119 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.79 135.69 39.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.7 -179.02 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -102.42 167.6 9.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.363 179.153 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.5 mp0 -64.34 -40.56 96.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.73 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 87.0 p -58.26 -42.52 86.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.937 0.398 . . . . 0.0 110.377 -178.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mm -60.19 -45.2 96.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.215 -178.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.8 m -59.3 -44.45 92.52 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.525 -177.743 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -59.31 -45.99 89.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.542 -178.642 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.5 mtt -58.21 -44.18 88.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.126 0.489 . . . . 0.0 110.428 -178.101 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -60.09 -48.24 82.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.292 -178.455 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.664 ' HA ' HD12 ' A' ' 14' ' ' ILE . 9.8 tp -60.83 -32.35 71.74 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.193 -178.88 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.7 -50.2 72.09 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.668 0.27 . . . . 0.0 110.636 178.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.55 -41.91 86.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.031 0.443 . . . . 0.0 110.418 179.281 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.699 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 97.7 mt -54.17 -52.96 32.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.654 178.724 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -53.35 -23.42 9.37 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.435 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -59.53 -33.83 71.88 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -177.655 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.7 mm -108.5 -42.43 5.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.823 0.344 . . . . 0.0 110.173 -177.476 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -117.09 77.85 9.46 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.18 -177.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -55.04 -21.07 25.63 Favored 'Trans proline' 0 N--CA 1.498 1.753 0 C-N-CA 121.516 1.477 . . . . 0.0 113.529 -175.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.1 p90 -90.87 9.96 28.21 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.574 0.954 . . . . 0.0 113.574 -174.734 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.53 127.87 33.66 Favored 'General case' 0 C--O 1.231 0.123 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 175.372 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 69.1 tttt -97.46 -40.47 8.66 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.651 -176.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -157.93 155.81 30.18 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.679 -0.408 . . . . 0.0 111.38 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 37.0 mt -89.79 140.16 16.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.951 177.141 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.6 t -92.74 -47.13 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.83 176.727 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.496 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.0 t0 -156.49 158.97 38.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.884 178.466 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.5 p -143.24 134.58 26.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.162 0.506 . . . . 0.0 111.323 -179.429 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 24.1 t -109.58 124.69 51.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.598 176.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.0 t -54.36 -38.88 66.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.302 -172.013 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -149.11 125.85 11.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.205 0.526 . . . . 0.0 111.81 -178.057 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.454 HG21 ' HB3' ' A' ' 52' ' ' PHE . 87.3 t -145.18 139.28 22.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 114.986 -1.006 . . . . 0.0 109.506 -177.524 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.04 149.83 50.7 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.041 -178.601 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.607 ' CD2' HG21 ' A' ' 46' ' ' THR . 12.8 t80 -96.61 133.44 41.11 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.379 0.609 . . . . 0.0 111.884 -176.262 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -127.79 139.87 52.4 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.222 177.12 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 93.8 m -122.73 146.15 47.76 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.347 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -108.22 130.6 55.14 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.862 0.363 . . . . 0.0 110.317 176.258 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 29.9 t-20 -101.54 116.24 32.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.998 -0.547 . . . . 0.0 109.983 177.304 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.8 m -68.13 -33.05 73.77 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.902 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.0 p -62.23 -37.02 83.8 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.178 -177.483 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -95.56 -21.41 18.28 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -178.654 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 69.0 45.29 0.93 Allowed 'General case' 0 C--O 1.231 0.108 0 CA-C-O 121.424 0.631 . . . . 0.0 109.489 -177.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 32.0 tp10 -156.05 152.37 27.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.013 -177.221 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.45 ' CB ' HD12 ' B' 1338 ' ' LEU . 85.2 m95 -86.78 143.67 27.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.296 176.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.7 tp10 -125.0 129.42 50.29 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 176.14 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 20.4 pttp -75.11 138.86 42.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.127 177.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.607 HG21 ' CD2' ' A' ' 33' ' ' PHE . 68.5 p -92.4 167.57 11.89 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.16 -178.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -82.94 12.29 5.11 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 178.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.1 t -101.29 106.53 19.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-O 120.962 0.41 . . . . 0.0 110.289 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -130.7 113.87 14.69 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 176.675 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.67 176.57 38.97 Favored Glycine 0 CA--C 1.52 0.391 0 C-N-CA 120.221 -0.99 . . . . 0.0 112.322 -169.307 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.465 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -80.91 134.93 35.82 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 175.341 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.454 ' HB3' HG21 ' A' ' 31' ' ' VAL . 7.9 t80 -98.51 129.64 45.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.849 0.356 . . . . 0.0 110.201 -176.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.465 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.7 m-85 -132.96 143.53 49.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.237 177.516 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.668 HD11 HG23 ' A' ' 116' ' ' ILE . 69.0 mt -101.58 128.65 53.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 172.328 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.699 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 12.3 m-30 -108.58 135.78 49.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.843 0.354 . . . . 0.0 111.183 -175.473 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 50.1 t60 -118.34 143.26 46.75 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.238 176.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 60.0 ttt180 -141.97 147.92 37.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.147 178.727 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -86.83 28.07 0.93 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 178.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -159.1 167.36 29.4 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 -63.94 128.47 92.99 Favored Pre-proline 0 CA--C 1.538 0.509 0 CA-C-O 118.436 -0.793 . . . . 0.0 110.002 -178.11 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -74.94 140.93 70.08 Favored 'Cis proline' 0 N--CA 1.497 1.722 0 CA-C-N 121.943 1.729 . . . . 0.0 111.753 -1.051 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -65.45 -47.06 77.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.085 -177.217 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -142.69 137.37 29.83 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.431 0.634 . . . . 0.0 110.936 -176.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.0 t -151.14 152.28 33.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.45 -177.244 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.414 HG13 HD11 ' A' ' 80' ' ' ILE . 41.8 mt -107.04 141.61 21.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -131.74 141.93 49.65 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.371 -177.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.3 mt -128.38 131.42 69.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.25 0.548 . . . . 0.0 110.237 174.141 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -98.76 99.47 10.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 114.957 -1.019 . . . . 0.0 109.626 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -73.74 105.88 5.23 Favored 'General case' 0 N--CA 1.463 0.188 0 O-C-N 123.679 0.612 . . . . 0.0 110.717 -176.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 -73.64 -41.3 62.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.587 -170.462 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 66.5 mt -72.17 -45.21 61.36 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.551 -174.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 57.5 m-20 -95.07 -3.32 48.41 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.702 1.001 . . . . 0.0 113.702 -175.32 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.416 HG22 ' O ' ' A' ' 73' ' ' THR . 10.9 m 54.72 43.53 29.97 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 121.516 0.674 . . . . 0.0 110.748 176.696 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 32.6 m -126.99 145.21 50.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.511 -178.443 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 13.6 p -90.75 130.91 36.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.25 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -119.41 122.32 41.5 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 175.564 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 34.6 t -125.4 145.14 33.26 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-O 120.614 0.245 . . . . 0.0 110.623 -177.202 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -148.68 126.39 5.73 Favored Pre-proline 0 CA--C 1.538 0.501 0 CA-C-O 118.747 -0.644 . . . . 0.0 110.498 174.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -75.27 150.91 37.69 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 121.621 1.547 . . . . 0.0 111.891 175.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.414 HD11 HG13 ' A' ' 65' ' ' ILE . 66.4 mt -93.68 120.35 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.156 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.416 179.071 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 68.3 p -99.33 154.25 18.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.785 175.113 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -93.7 26.49 16.01 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.721 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.5 t -111.04 -12.86 14.16 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.411 0.522 . . . . 0.0 112.411 174.515 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 78.0 mt -67.52 146.14 54.23 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.072 0.463 . . . . 0.0 111.262 -176.098 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.1 tt0 -117.62 135.85 53.7 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.801 176.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 63.0 mt -112.18 155.56 23.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.923 0.392 . . . . 0.0 110.8 -177.488 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -147.55 144.16 28.31 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.079 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.0 t -99.48 109.09 21.68 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.668 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -106.77 103.78 48.5 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 171.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.18 143.52 44.31 Favored 'Trans proline' 0 N--CA 1.496 1.671 0 CA-C-N 120.527 1.224 . . . . 0.0 112.329 -169.607 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -90.4 14.93 48.91 Favored 'Cis proline' 0 N--CA 1.499 1.842 0 CA-C-N 121.05 1.411 . . . . 0.0 113.481 -4.443 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -95.46 170.67 9.2 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 122.419 0.288 . . . . 0.0 110.776 -177.582 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 52.4 tp -116.32 133.47 55.99 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 174.045 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.441 HD11 ' CG2' ' A' ' 102' ' ' ILE . 11.1 tp -125.09 140.51 52.82 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.392 -173.688 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 48.0 p90 -142.97 150.08 39.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.943 0.402 . . . . 0.0 110.523 175.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 26.5 mtm180 -102.37 146.9 27.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.26 -175.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -128.46 157.17 41.85 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.901 0.857 . . . . 0.0 111.367 -179.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 54.6 tt0 -49.57 150.05 2.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.724 -177.255 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 64.56 30.95 12.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.241 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 42.1 t 68.88 35.27 2.97 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.005 0.431 . . . . 0.0 111.645 164.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -98.96 140.61 32.85 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 177.531 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.441 ' CG2' HD11 ' A' ' 94' ' ' LEU . 78.9 mt -114.75 124.05 71.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -177.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -135.14 146.1 48.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.423 -178.409 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -144.33 169.35 26.4 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 120.888 -0.673 . . . . 0.0 111.648 -177.118 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -126.16 142.81 51.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.027 0.441 . . . . 0.0 110.752 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 73.7 t90 -106.31 125.01 50.47 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.443 174.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.437 ' CD1' HG22 ' A' ' 31' ' ' VAL . 64.5 m-85 -111.29 139.69 46.48 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 123.281 0.363 . . . . 0.0 110.611 -179.138 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -51.74 -37.53 51.46 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.678 179.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -132.54 136.06 46.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.42 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 84.5 p -62.8 -41.62 99.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.303 -177.507 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -59.85 -44.02 94.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.509 0.671 . . . . 0.0 110.016 178.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -56.51 -44.67 80.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.067 178.694 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 50.2 t -59.2 -39.72 83.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.519 177.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -58.89 -45.94 89.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.852 0.358 . . . . 0.0 110.642 -177.006 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 22.8 ttp-105 -61.33 -50.16 74.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.791 -177.142 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.668 HG23 HD11 ' A' ' 54' ' ' ILE . 30.2 mm -58.56 -44.16 88.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.051 0.453 . . . . 0.0 110.0 -178.19 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 59.7 p -59.85 -43.99 94.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.698 -177.655 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.56 -43.75 94.08 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 -178.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.496 HD13 ' HB2' ' A' ' 26' ' ' ASP . 12.0 mt -58.97 -48.5 81.31 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.05 0.453 . . . . 0.0 110.598 -178.382 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 54.5 t -59.07 -44.3 91.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.067 -178.495 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -57.39 -42.14 81.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.63 -178.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.9 -45.25 96.56 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -179.12 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 62.1 mt -58.65 -42.19 87.81 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.926 0.393 . . . . 0.0 110.642 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 88.0 mt -58.89 -40.46 84.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.867 -178.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 26.7 pttt -90.78 -8.13 50.53 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -179.209 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 29.9 t -113.99 142.72 45.81 Favored 'General case' 0 C--O 1.231 0.115 0 O-C-N 122.144 -0.348 . . . . 0.0 110.496 -179.322 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 97.5 mttt . . . . . 0 C--O 1.221 -0.423 0 CA-C-O 117.893 -1.051 . . . . 0.0 110.556 179.946 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.323 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -68.64 144.21 59.34 Favored 'Trans proline' 0 N--CA 1.495 1.565 0 C-N-CA 121.356 1.371 . . . . 0.0 111.892 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -97.89 122.28 40.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.533 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -72.93 153.78 90.98 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.492 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -52.08 150.93 17.69 Favored 'Trans proline' 0 N--CA 1.495 1.582 0 C-N-CA 121.272 1.315 . . . . 0.0 111.951 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.11 -45.33 73.99 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.061 -178.436 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 25.7 tp -138.14 131.47 30.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.774 0.321 . . . . 0.0 110.906 -178.424 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -135.98 128.54 30.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.523 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -98.99 -67.13 0.86 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.582 179.366 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -138.3 146.97 43.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.498 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 61.1 ttm-85 -102.46 119.23 38.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.512 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1329 ' ' ALA . . . . . 0.434 ' HB1' ' HD2' ' B' 1330 ' ' PRO . . . -108.56 161.53 23.21 Favored Pre-proline 0 CA--C 1.531 0.235 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.517 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 1330 ' ' PRO . . . . . 0.434 ' HD2' ' HB1' ' B' 1329 ' ' ALA . 34.1 Cg_endo -65.31 143.47 77.05 Favored 'Trans proline' 0 N--CA 1.496 1.619 0 C-N-CA 121.243 1.295 . . . . 0.0 111.793 179.465 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -113.9 99.85 51.12 Favored Pre-proline 0 CA--C 1.533 0.289 0 CA-C-O 119.216 -0.421 . . . . 0.0 110.516 -179.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -57.9 128.98 31.06 Favored 'Trans proline' 0 N--CA 1.496 1.623 0 C-N-CA 121.112 1.208 . . . . 0.0 111.538 177.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 101.14 -5.06 55.7 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 121.263 -0.494 . . . . 0.0 113.374 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -54.44 145.89 17.27 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 118.278 1.039 . . . . 0.0 110.914 178.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 11.3 ttp -61.27 143.66 92.47 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.158 -178.397 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -63.4 154.01 70.96 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 121.241 1.294 . . . . 0.0 111.522 175.539 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 37.0 t30 -99.21 99.88 10.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.451 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1338 ' ' LEU . . . . . 0.45 HD12 ' CB ' ' A' ' 43' ' ' TRP . 19.9 mt -67.35 134.96 93.18 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 118.493 -0.765 . . . . 0.0 109.613 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -79.15 139.63 15.13 Favored 'Trans proline' 0 N--CA 1.493 1.455 0 CA-C-N 120.394 1.176 . . . . 0.0 111.193 174.325 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 6.7 mtmp? -97.28 125.99 43.51 Favored Pre-proline 0 CA--C 1.535 0.403 0 CA-C-O 118.343 -0.837 . . . . 0.0 110.119 178.349 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -61.86 165.34 14.3 Favored 'Trans proline' 0 N--CA 1.497 1.722 0 CA-C-N 120.657 1.27 . . . . 0.0 111.655 177.133 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -49.27 156.98 2.2 Favored 'Trans proline' 0 N--CA 1.497 1.679 0 C-N-CA 121.395 1.397 . . . . 0.0 111.866 178.736 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1343 ' ' LEU . . . . . 0.515 ' H ' HD12 ' B' 1343 ' ' LEU . 6.2 mp -50.17 -29.19 8.74 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -176.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -56.4 -35.79 68.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.733 0.301 . . . . 0.0 111.429 -176.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 54.9 t90 -60.77 -48.14 83.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.955 0.407 . . . . 0.0 110.465 -176.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -65.23 -48.11 74.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.921 0.391 . . . . 0.0 110.804 -178.598 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -57.81 -44.39 86.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.964 0.412 . . . . 0.0 110.758 -176.535 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -59.19 -47.9 83.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.398 -177.312 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -57.82 -45.27 86.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.684 -177.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1350 ' ' GLN . . . . . 0.54 ' O ' ' HB3' ' B' 1354 ' ' ALA . 45.7 mt-30 -61.23 -46.14 91.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.319 -176.427 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 60.7 tttm -61.84 -47.71 83.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.138 -175.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 -64.29 -48.97 73.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.804 -176.232 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -90.94 15.12 12.03 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 -176.655 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1354 ' ' ALA . . . . . 0.54 ' HB3' ' O ' ' B' 1350 ' ' GLN . . . -143.03 150.9 40.21 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-O 120.874 0.369 . . . . 0.0 110.678 178.745 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 27.8 tp . . . . . 0 C--O 1.221 -0.421 0 CA-C-O 118.07 -0.967 . . . . 0.0 110.57 -179.863 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.306 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -69.54 130.11 19.03 Favored 'Trans proline' 0 N--CA 1.496 1.633 0 CA-C-N 118.841 1.32 . . . . 0.0 112.01 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -110.67 -40.44 4.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.766 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 95.3 mmm -56.41 -38.1 71.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.919 -179.471 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -56.7 139.91 48.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.76 0.314 . . . . 0.0 110.704 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -84.62 125.86 32.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.612 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 0' ' ' LEU . . . . . 0.513 ' H ' HD12 ' A' ' 0' ' ' LEU . 6.3 mp -57.74 -40.53 79.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.714 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.2 mtt -92.5 133.23 36.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.473 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.53 137.42 50.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.634 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 77.1 m-20 -74.34 157.67 35.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.61 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -60.1 -37.07 78.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.004 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.2 p -57.46 -41.54 80.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.976 0.417 . . . . 0.0 110.427 -179.569 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.2 mm -60.18 -44.44 95.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.198 -179.315 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.4 m -59.05 -44.71 91.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.991 0.424 . . . . 0.0 110.534 -177.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -59.36 -47.12 86.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.4 -178.472 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 87.2 mtp -58.29 -42.49 86.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.127 0.489 . . . . 0.0 110.41 -178.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -59.88 -48.5 81.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.298 -178.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.671 ' HA ' HD12 ' A' ' 14' ' ' ILE . 8.7 tp -60.4 -33.43 72.47 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.127 -178.68 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.5 -50.03 73.03 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.65 0.262 . . . . 0.0 110.688 179.041 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.11 -41.18 87.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.952 0.406 . . . . 0.0 110.565 179.173 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.703 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 96.8 mt -54.19 -52.88 33.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.618 178.507 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -53.61 -24.06 12.86 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -177.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.7 mtpt -60.25 -33.07 71.79 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -177.453 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 45.8 mm -109.12 -41.25 4.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.802 0.334 . . . . 0.0 110.407 -176.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -116.27 77.82 7.66 Favored Pre-proline 0 CA--C 1.535 0.392 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.311 -177.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -53.72 -20.46 17.06 Favored 'Trans proline' 0 N--CA 1.498 1.784 0 C-N-CA 121.469 1.446 . . . . 0.0 113.427 -176.881 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.2 p90 -94.42 17.63 12.66 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -174.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -92.45 127.5 37.96 Favored 'General case' 0 C--O 1.232 0.133 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 173.772 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.463 ' O ' HD21 ' A' ' 11' ' ' LEU . 79.2 tttt -101.57 -40.61 6.94 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.75 -176.338 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -150.59 156.37 41.25 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.976 0.417 . . . . 0.0 111.336 -179.463 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 58.1 mt -93.09 136.5 24.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.174 177.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.1 t -88.44 -47.1 15.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.753 176.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.495 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -152.34 157.01 40.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.865 177.883 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.4 p -143.29 131.98 22.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.988 0.423 . . . . 0.0 111.056 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.6 t -109.13 126.17 52.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.706 177.334 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.2 t -54.47 -39.08 67.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.243 -171.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -150.21 127.04 11.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.242 0.544 . . . . 0.0 111.722 -178.724 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.472 HG21 ' HB3' ' A' ' 52' ' ' PHE . 94.6 t -145.14 140.5 22.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.437 -177.622 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.46 149.81 51.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.14 -177.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -97.91 132.08 43.81 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.249 0.547 . . . . 0.0 111.588 -176.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -125.61 142.31 51.57 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.759 179.511 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 80.4 m -120.81 148.14 44.41 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.184 -0.672 . . . . 0.0 109.184 177.385 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -109.48 131.97 54.56 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.975 0.417 . . . . 0.0 110.483 176.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -104.25 116.15 31.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.969 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 85.1 p -69.85 -31.03 68.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.137 -176.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -61.9 -38.1 87.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.662 0.267 . . . . 0.0 110.914 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -95.49 -21.42 18.32 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -178.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 28.3 t30 69.16 43.67 1.07 Allowed 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.366 0.603 . . . . 0.0 109.739 -177.807 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -151.07 164.52 36.27 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.99 -177.364 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 85.0 m95 -96.01 141.55 29.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.468 178.313 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -123.88 127.46 48.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.945 177.024 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.9 ttpp -75.1 139.96 43.12 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 62.3 p -92.34 173.35 7.85 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.088 -179.228 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -84.83 12.6 7.07 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 178.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.7 t -104.28 106.48 20.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 121.0 0.428 . . . . 0.0 110.311 179.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -130.47 115.03 16.26 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 176.259 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.63 176.51 38.95 Favored Glycine 0 CA--C 1.52 0.367 0 C-N-CA 120.08 -1.057 . . . . 0.0 112.182 -169.534 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.454 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -81.36 136.51 35.74 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 175.474 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.472 ' HB3' HG21 ' A' ' 31' ' ' VAL . 8.9 t80 -99.15 129.91 45.43 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.085 -176.95 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.454 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 9.1 m-85 -133.46 143.13 48.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.287 177.759 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.678 HD11 HG23 ' A' ' 116' ' ' ILE . 69.9 mt -101.65 128.14 54.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 172.324 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.703 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 13.7 m-30 -108.42 134.39 51.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.836 0.351 . . . . 0.0 111.136 -174.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 59.6 t60 -119.68 140.09 51.2 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.19 176.428 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.3 tpt180 -142.15 149.84 40.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.709 177.056 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -86.85 28.12 0.93 Allowed 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.79 170.19 22.93 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -64.13 125.98 89.26 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-O 118.46 -0.781 . . . . 0.0 110.005 -178.223 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.65 140.93 65.37 Favored 'Cis proline' 0 N--CA 1.497 1.682 0 CA-C-N 121.844 1.694 . . . . 0.0 111.833 -1.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -65.7 -47.71 74.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.059 -177.369 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -142.15 135.38 28.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.458 0.647 . . . . 0.0 110.926 -176.537 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.0 t -150.93 152.36 33.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.413 -177.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.2 mt -107.93 140.13 27.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -131.73 142.0 49.67 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.625 -177.038 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.0 mt -127.89 130.9 70.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.238 0.542 . . . . 0.0 110.053 173.533 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -99.21 99.61 10.61 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.753 -179.442 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -71.69 105.07 3.56 Favored 'General case' 0 C--N 1.332 -0.183 0 O-C-N 123.757 0.661 . . . . 0.0 110.672 -177.295 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -72.52 -42.05 65.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.5 -170.415 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.8 mt -71.95 -45.27 61.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.702 -174.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 54.7 m-20 -95.02 -3.35 48.52 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -175.495 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.9 m 54.94 43.6 29.65 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.399 0.619 . . . . 0.0 110.648 177.183 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.7 m -125.35 141.59 51.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.531 -178.31 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 14.8 p -88.15 130.18 35.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.291 -179.256 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -118.85 122.29 42.0 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 175.038 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 30.3 t -125.5 145.75 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 120.678 0.275 . . . . 0.0 110.532 -177.133 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -149.14 126.36 5.52 Favored Pre-proline 0 CA--C 1.538 0.488 0 CA-C-O 118.698 -0.667 . . . . 0.0 110.561 174.093 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -75.41 150.95 37.12 Favored 'Trans proline' 0 N--CA 1.498 1.757 0 C-N-CA 121.463 1.442 . . . . 0.0 112.305 177.62 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 69.2 mt -92.65 133.93 32.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 CA-C-O 120.977 0.418 . . . . 0.0 110.249 178.122 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.0 p -132.14 158.48 41.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.775 177.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -94.68 35.03 4.4 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.026 -178.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.7 t -108.47 -23.31 11.92 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 173.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.5 mt -68.36 148.58 50.5 Favored 'General case' 0 C--O 1.23 0.077 0 CA-C-O 120.922 0.391 . . . . 0.0 111.324 -176.363 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.5 tt0 -118.16 135.84 53.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.784 176.51 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.4 mt -113.9 157.93 21.74 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.075 0.464 . . . . 0.0 111.0 -176.651 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -148.14 139.54 23.56 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.197 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.2 t -97.33 109.17 21.98 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.793 -179.025 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -106.71 103.74 48.16 Favored Pre-proline 0 C--N 1.329 -0.321 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 172.219 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -71.18 139.61 35.74 Favored 'Trans proline' 0 N--CA 1.496 1.676 0 CA-C-N 120.619 1.257 . . . . 0.0 112.002 -171.033 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -89.11 9.0 65.74 Favored 'Cis proline' 0 N--CA 1.501 1.943 0 CA-C-N 121.213 1.469 . . . . 0.0 113.764 -4.282 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -84.62 170.11 13.69 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.7 0.286 . . . . 0.0 111.223 -177.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 53.7 tp -118.66 131.75 56.17 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 170.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.449 HD11 ' CG2' ' A' ' 102' ' ' ILE . 11.6 tp -123.63 139.56 53.87 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 110.408 -0.219 . . . . 0.0 110.408 -174.891 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 11.7 p90 -144.49 151.3 38.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.938 0.399 . . . . 0.0 110.651 176.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.4 mtm180 -102.13 148.93 24.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.023 -176.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.2 m120 -130.91 165.65 22.63 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.841 0.829 . . . . 0.0 111.666 -178.451 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -48.39 148.17 2.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.092 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 71.9 mtt85 63.17 30.86 15.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.212 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 52.1 m 66.55 35.18 5.57 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.921 0.391 . . . . 0.0 111.598 166.108 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -98.16 149.45 22.52 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 178.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.616 HD13 ' CH2' ' B' 1345 ' ' TRP . 82.4 mt -117.89 127.84 75.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 121.064 0.459 . . . . 0.0 109.824 -177.78 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -135.99 150.38 49.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.382 177.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -142.25 169.36 25.43 Favored Glycine 0 CA--C 1.522 0.53 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 -176.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -125.38 139.45 53.66 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.847 0.356 . . . . 0.0 110.622 -179.448 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 7.4 t90 -107.75 127.55 53.78 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.57 175.243 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.451 ' CD2' HG22 ' A' ' 31' ' ' VAL . 71.4 m-85 -116.14 144.2 44.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.832 0.349 . . . . 0.0 110.682 -179.743 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -51.57 -37.49 49.98 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.626 178.461 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -134.06 135.92 43.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.846 0.355 . . . . 0.0 110.531 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.8 m -61.33 -42.01 97.98 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.098 -177.432 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -59.46 -43.5 93.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.401 0.62 . . . . 0.0 110.081 178.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -56.31 -44.84 80.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.084 178.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 42.9 t -59.94 -39.85 86.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.708 178.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -59.28 -45.31 91.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.771 0.319 . . . . 0.0 110.608 -177.066 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -60.08 -49.13 78.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.518 -177.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.678 HG23 HD11 ' A' ' 54' ' ' ILE . 35.3 mm -58.43 -45.49 89.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.047 0.451 . . . . 0.0 110.094 -178.392 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 68.3 p -59.72 -43.34 94.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.756 -177.523 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.74 -44.36 94.17 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 110.66 -0.976 . . . . 0.0 110.66 -179.014 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.495 HD13 ' HB2' ' A' ' 26' ' ' ASP . 10.8 mt -58.77 -48.29 81.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.081 0.467 . . . . 0.0 110.503 -178.403 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 52.0 t -58.91 -43.78 89.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.171 -178.623 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -57.46 -42.41 82.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.635 -178.66 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.32 -43.16 99.47 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 78.2 mt -61.79 -41.37 97.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.833 0.349 . . . . 0.0 111.044 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 27.6 mt -65.87 -44.82 84.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.682 -177.263 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 26.7 pttt -72.7 -35.35 67.59 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.77 -175.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 29.1 t -106.11 134.98 48.38 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.837 0.351 . . . . 0.0 110.743 -178.163 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt . . . . . 0 C--O 1.221 -0.442 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.538 179.85 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.316 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -50.04 137.0 37.22 Favored 'Trans proline' 0 N--CA 1.495 1.587 0 CA-C-N 118.85 1.325 . . . . 0.0 112.088 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -104.6 126.15 51.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.518 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -71.02 154.54 94.13 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.538 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -49.02 108.98 0.22 Allowed 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 121.31 1.34 . . . . 0.0 112.034 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 29.3 tp -62.89 -39.3 94.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.944 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1324 ' ' LEU . . . . . 0.491 ' N ' HD12 ' B' 1324 ' ' LEU . 6.8 mp -85.18 123.45 30.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.909 0.385 . . . . 0.0 110.642 -179.712 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -143.5 157.68 44.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.455 179.415 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.87 -40.92 85.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.676 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -136.32 129.08 30.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.389 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 83.0 mtm180 -74.65 123.38 24.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.566 -179.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.61 155.24 40.89 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.554 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -77.5 153.76 30.9 Favored 'Trans proline' 0 N--CA 1.492 1.394 0 C-N-CA 121.464 1.443 . . . . 0.0 111.994 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -55.38 -61.64 5.74 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.191 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -63.66 128.93 23.46 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 120.935 1.09 . . . . 0.0 111.661 -176.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 96.25 -4.97 65.17 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 121.146 -0.549 . . . . 0.0 113.404 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -56.37 132.59 51.47 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-N 118.209 1.005 . . . . 0.0 110.618 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 6.4 ttt -92.94 140.46 23.47 Favored Pre-proline 0 CA--C 1.534 0.349 0 CA-C-O 118.907 -0.568 . . . . 0.0 109.974 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -74.62 147.04 35.16 Favored 'Trans proline' 0 N--CA 1.495 1.577 0 C-N-CA 121.219 1.279 . . . . 0.0 111.652 176.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 5.3 p30 -96.88 104.42 16.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.826 -178.677 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 10.8 mt -65.96 150.37 96.63 Favored Pre-proline 0 C--N 1.33 -0.275 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 177.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -79.14 139.73 15.2 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 C-N-CA 121.101 1.201 . . . . 0.0 111.241 175.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -97.3 125.96 43.59 Favored Pre-proline 0 CA--C 1.537 0.448 0 CA-C-O 118.474 -0.774 . . . . 0.0 109.915 178.653 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -78.17 169.05 20.91 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 121.272 1.315 . . . . 0.0 111.792 176.091 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -62.0 156.59 48.56 Favored 'Trans proline' 0 N--CA 1.495 1.616 0 C-N-CA 121.261 1.308 . . . . 0.0 111.41 177.641 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.9 tp -50.04 -28.55 7.22 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.451 0.538 . . . . 0.0 112.451 -176.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 67.9 t80 -54.84 -37.31 66.02 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.773 0.32 . . . . 0.0 111.304 -176.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1345 ' ' TRP . . . . . 0.616 ' CH2' HD13 ' A' ' 102' ' ' ILE . 46.1 t90 -61.61 -48.07 82.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.411 -176.617 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -61.88 -48.98 78.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.025 0.441 . . . . 0.0 110.41 -177.657 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -58.92 -45.13 91.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.879 -176.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -59.28 -47.03 86.89 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.651 -176.501 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.23 -47.21 86.95 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.779 -177.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -61.1 -47.2 87.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.522 -173.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 31.1 pttt -70.94 -41.27 71.37 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.884 -175.332 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -60.52 -47.73 84.88 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 121.057 -0.257 . . . . 0.0 111.245 -178.584 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -65.0 -37.05 86.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.214 -179.265 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -153.25 151.57 30.2 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.911 0.386 . . . . 0.0 110.593 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 27.6 tp . . . . . 0 C--O 1.22 -0.464 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.518 179.853 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.345 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -67.98 139.46 47.15 Favored 'Trans proline' 0 N--CA 1.496 1.627 0 C-N-CA 121.325 1.35 . . . . 0.0 111.945 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -56.87 -40.57 76.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.798 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 65.6 mtt -98.01 166.91 11.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.633 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -139.76 166.81 23.63 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.538 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -57.53 145.75 32.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.548 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 29.4 tp -56.94 -40.83 77.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.692 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.7 mtt -99.03 129.96 45.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.515 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -178.09 102.91 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.58 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.9 p-10 -125.81 73.97 1.38 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.365 0.602 . . . . 0.0 110.593 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -67.32 -36.42 81.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.318 -178.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 85.8 p -57.37 -42.03 81.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.988 0.423 . . . . 0.0 110.558 -177.466 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.9 mm -60.43 -44.47 96.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.193 -178.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 35.2 m -59.41 -45.54 91.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.931 0.396 . . . . 0.0 110.499 -177.604 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -59.77 -45.42 92.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.553 -178.476 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 44.7 ttm -58.27 -43.04 87.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.049 0.452 . . . . 0.0 110.382 -178.34 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -60.5 -49.62 76.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.348 -178.199 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.75 ' HA ' HD12 ' A' ' 14' ' ' ILE . 13.7 tp -61.52 -30.67 70.78 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.412 -178.832 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.12 -50.12 71.75 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.621 0.248 . . . . 0.0 110.527 178.029 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.86 -41.05 86.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.976 0.417 . . . . 0.0 110.565 178.585 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.75 HD12 ' HA ' ' A' ' 11' ' ' LEU . 95.7 mt -54.21 -52.98 32.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.643 178.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 76.7 mttt -55.08 -26.8 40.32 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -177.059 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -61.98 -29.92 70.58 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 -177.238 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.7 mm -109.76 -40.49 4.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.699 0.285 . . . . 0.0 110.391 -176.206 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -115.37 83.23 10.28 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.241 -178.498 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -54.22 -21.39 22.39 Favored 'Trans proline' 0 N--CA 1.498 1.751 0 C-N-CA 121.444 1.429 . . . . 0.0 113.549 -175.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 34.7 p90 -97.29 20.52 11.38 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -175.041 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -102.89 130.87 50.07 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 173.321 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.487 ' O ' HD21 ' A' ' 11' ' ' LEU . 55.5 tttm -119.74 -35.19 3.57 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.625 0.25 . . . . 0.0 111.571 -175.644 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 85.4 tt0 -128.94 144.6 51.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.852 0.358 . . . . 0.0 110.585 -177.385 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.489 HG13 HD13 ' A' ' 11' ' ' LEU . 58.3 mt -99.04 131.02 47.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.803 173.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.3 t -90.42 -47.19 14.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.375 -0.375 . . . . 0.0 109.992 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.51 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -156.95 157.08 34.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.951 178.642 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.9 p -142.71 132.0 23.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.224 0.535 . . . . 0.0 111.293 -179.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.554 ' HG ' ' HD2' ' A' ' 107' ' ' PHE . 35.4 t -105.41 123.73 48.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.526 176.247 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 88.1 p -53.97 -37.16 63.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.455 -172.013 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -151.1 126.27 9.91 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.128 0.49 . . . . 0.0 111.449 -179.026 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.409 HG21 ' HB3' ' A' ' 52' ' ' PHE . 99.0 t -145.2 136.53 20.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.671 -177.548 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -127.47 149.85 49.92 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.966 -178.252 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -99.26 132.03 44.87 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-O 121.29 0.567 . . . . 0.0 111.931 -176.269 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -126.21 141.62 51.85 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.348 178.592 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.5 m -122.06 145.0 48.57 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 177.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -108.3 131.94 54.21 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.929 0.395 . . . . 0.0 110.451 176.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -102.99 114.34 28.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.858 176.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.4 m -67.86 -32.37 72.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.026 -177.231 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -62.32 -37.49 85.78 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.665 0.269 . . . . 0.0 111.129 -177.296 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -95.09 -21.48 18.52 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 32.0 t30 69.17 46.03 0.83 Allowed 'General case' 0 C--O 1.231 0.11 0 CA-C-O 121.505 0.669 . . . . 0.0 109.441 -177.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 72.7 tt0 -155.43 152.72 29.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.865 -177.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -89.34 143.76 26.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.387 177.703 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -124.35 128.53 49.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.832 176.118 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 26.4 pttm -75.45 140.16 42.71 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.031 178.262 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 52.5 p -92.3 170.21 9.97 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.111 -178.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -83.83 12.58 5.85 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 177.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.7 t -104.07 106.49 20.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.067 0.46 . . . . 0.0 110.281 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -132.38 115.79 16.03 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 176.084 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.41 38.97 Favored Glycine 0 CA--C 1.519 0.341 0 C-N-CA 120.153 -1.022 . . . . 0.0 112.5 -169.302 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.492 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -81.42 133.42 35.41 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 174.698 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.409 ' HB3' HG21 ' A' ' 31' ' ' VAL . 4.8 t80 -98.46 128.03 44.65 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -175.831 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.492 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.0 m-85 -132.43 142.66 49.35 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.353 177.48 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.626 HD11 HG23 ' A' ' 116' ' ' ILE . 69.6 mt -101.64 127.94 54.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 171.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.704 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 15.6 m-30 -108.47 135.55 49.56 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.812 0.339 . . . . 0.0 111.242 -176.299 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 37.1 t60 -114.9 143.26 45.42 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.935 173.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.5 tpt85 -142.1 148.94 39.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.456 . . . . 0.0 109.986 176.695 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -86.87 28.11 0.93 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.29 159.27 37.38 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -63.88 134.46 95.92 Favored Pre-proline 0 CA--C 1.537 0.475 0 CA-C-O 118.651 -0.69 . . . . 0.0 110.141 -175.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -67.43 140.81 54.57 Favored 'Cis proline' 0 N--CA 1.498 1.779 0 CA-C-N 121.603 1.608 . . . . 0.0 111.371 -3.025 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -68.54 -47.83 65.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.154 -177.037 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.473 ' HB3' HD12 ' A' ' 80' ' ' ILE . 76.8 m80 -142.57 135.61 28.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.322 0.582 . . . . 0.0 110.84 -177.014 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 5.2 t -149.82 152.2 34.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.35 -176.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 56.4 mt -110.45 139.51 33.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.596 -179.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -131.75 142.12 49.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.723 -176.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.5 mt -123.15 127.1 74.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.144 0.497 . . . . 0.0 109.783 172.141 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -93.13 99.54 12.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.505 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -73.4 105.52 4.81 Favored 'General case' 0 C--N 1.332 -0.189 0 O-C-N 123.818 0.699 . . . . 0.0 110.881 -175.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 69.3 mtm180 -73.04 -42.43 63.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.602 -170.595 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.5 mt -72.94 -45.08 60.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.63 -174.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -94.97 -3.38 48.6 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -175.355 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 72.0 p 50.8 43.58 28.2 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.429 0.633 . . . . 0.0 111.238 177.2 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 35.5 m -128.27 131.35 48.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.408 -179.32 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 77.1 p -74.43 130.02 38.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.429 -179.224 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -117.03 122.2 43.52 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 173.154 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 39.6 t -125.56 146.8 30.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 120.852 0.358 . . . . 0.0 110.802 -177.387 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -149.51 126.45 5.41 Favored Pre-proline 0 CA--C 1.538 0.485 0 CA-C-O 118.723 -0.656 . . . . 0.0 110.354 174.359 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -75.3 150.96 37.62 Favored 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 121.443 1.429 . . . . 0.0 112.033 177.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.473 HD12 ' HB3' ' A' ' 63' ' ' HIS . 65.2 mt -87.12 131.95 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.138 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.586 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.7 p -132.16 157.98 42.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.599 176.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.543 ' HA2' HD22 ' A' ' 124' ' ' LEU . . . -108.83 38.91 3.1 Favored Glycine 0 CA--C 1.523 0.592 0 C-N-CA 121.115 -0.564 . . . . 0.0 111.856 -177.769 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 10.5 t -103.68 -30.07 10.67 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.767 -0.217 . . . . 0.0 111.156 172.001 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.23 149.0 44.97 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.828 0.347 . . . . 0.0 111.201 -176.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -106.52 141.71 37.37 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 175.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 66.9 mt -111.8 159.75 18.0 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.789 0.328 . . . . 0.0 110.504 -178.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -151.12 145.19 25.29 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 177.003 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 26.2 t -102.51 109.31 20.9 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.512 178.325 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -106.81 103.76 48.53 Favored Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 173.126 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -69.86 140.63 42.78 Favored 'Trans proline' 0 N--CA 1.497 1.7 0 CA-C-N 120.496 1.213 . . . . 0.0 112.074 -170.538 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -88.95 9.46 64.52 Favored 'Cis proline' 0 N--CA 1.5 1.905 0 CA-C-N 121.193 1.462 . . . . 0.0 113.697 -4.319 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -86.75 167.79 14.11 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.798 0.333 . . . . 0.0 111.109 -177.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 58.1 tp -115.75 133.97 55.49 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 170.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.474 HD21 ' HZ2' ' B' 1345 ' ' TRP . 12.4 tp -128.4 140.14 52.0 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.557 0.218 . . . . 0.0 110.469 -173.065 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 19.8 p90 -146.94 165.1 30.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.918 0.389 . . . . 0.0 110.592 176.641 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 37.8 mtt-85 -101.74 148.27 25.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.158 -178.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -128.83 163.94 24.12 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.867 0.841 . . . . 0.0 111.55 -177.54 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 32.0 mp0 -49.31 147.77 2.98 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.873 -176.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 79.6 mtm180 63.38 30.97 15.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.119 -0.946 . . . . 0.0 112.207 178.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 50.3 m 67.36 35.22 4.42 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.916 0.389 . . . . 0.0 111.535 167.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -101.49 152.71 20.44 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 179.333 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.519 HD13 ' CH2' ' B' 1345 ' ' TRP . 77.1 mt -111.07 129.6 66.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -179.178 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -137.96 149.39 46.1 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.897 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.96 168.85 26.37 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 111.274 -0.73 . . . . 0.0 111.274 -177.275 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -125.29 138.61 54.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.815 0.341 . . . . 0.0 110.602 -179.18 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 7.6 t90 -104.12 122.61 45.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.536 175.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.554 ' HD2' ' HG ' ' A' ' 28' ' ' SER . 35.9 m-85 -112.51 143.02 44.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.771 0.319 . . . . 0.0 110.554 -179.688 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 72.3 t80 -50.7 -35.87 33.29 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.702 178.38 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.9 t-20 -136.27 134.92 38.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.762 0.315 . . . . 0.0 110.462 179.219 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.6 t -61.68 -42.07 98.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.089 -177.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 -60.29 -43.54 96.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.375 0.607 . . . . 0.0 110.158 179.261 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 49.3 tt0 -56.62 -45.88 81.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.604 0.716 . . . . 0.0 110.0 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 38.4 t -60.56 -38.29 84.06 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.854 178.577 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -58.85 -46.22 88.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.923 0.392 . . . . 0.0 110.44 -177.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 51.2 mtp180 -58.98 -47.63 84.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.073 0.463 . . . . 0.0 110.552 -178.434 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.626 HG23 HD11 ' A' ' 54' ' ' ILE . 29.1 mm -58.23 -45.64 88.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.085 -179.03 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.0 p -59.29 -42.98 92.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.72 -177.103 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.6 -44.99 93.71 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.614 -0.995 . . . . 0.0 110.614 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.51 HD13 ' HB2' ' A' ' 26' ' ' ASP . 10.4 mt -58.67 -49.1 78.78 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.181 0.515 . . . . 0.0 110.491 -178.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.465 HG12 HD11 ' A' ' 124' ' ' LEU . 49.3 t -58.53 -41.42 81.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.265 -178.054 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.416 ' HA ' HD12 ' A' ' 124' ' ' LEU . 3.3 m-20 -58.5 -43.76 89.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.89 0.376 . . . . 0.0 110.593 -179.112 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -60.75 -40.78 98.58 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.262 -0.735 . . . . 0.0 111.262 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.9 mt -65.69 -43.06 90.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.645 0.26 . . . . 0.0 111.414 179.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.543 HD22 ' HA2' ' A' ' 82' ' ' GLY . 18.1 mt -62.37 -44.93 95.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.258 -176.388 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 29.5 pttt -70.41 -37.62 74.49 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.124 -178.236 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 56.5 p -73.46 162.96 28.7 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.789 0.328 . . . . 0.0 110.444 179.106 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 22.9 pttm . . . . . 0 C--O 1.221 -0.44 0 CA-C-O 118.02 -0.991 . . . . 0.0 110.74 -179.92 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.266 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.84 137.92 34.61 Favored 'Trans proline' 0 N--CA 1.495 1.578 0 CA-C-N 118.836 1.318 . . . . 0.0 112.02 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -101.15 122.16 43.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.521 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -73.96 152.97 88.85 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.531 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -83.88 133.93 6.05 Favored 'Trans proline' 0 N--CA 1.491 1.368 0 C-N-CA 121.491 1.46 . . . . 0.0 112.249 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 79.0 mt -60.66 -41.62 95.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.429 179.519 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.3 mt -102.86 144.43 31.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.5 179.497 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -80.83 129.46 34.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.479 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -150.01 -66.94 0.21 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.542 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -102.07 152.46 20.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.573 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -112.48 141.59 46.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.435 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -102.33 159.87 28.06 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.511 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -69.59 146.53 61.52 Favored 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 121.326 1.351 . . . . 0.0 111.947 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -144.63 159.67 50.25 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.611 -179.618 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -57.92 128.95 30.92 Favored 'Trans proline' 0 N--CA 1.495 1.58 0 C-N-CA 121.195 1.263 . . . . 0.0 111.713 -178.787 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 100.76 -5.17 56.58 Favored Glycine 0 CA--C 1.534 1.234 0 CA-C-O 119.639 -0.534 . . . . 0.0 113.499 179.13 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -92.16 143.92 25.95 Favored 'General case' 0 C--O 1.231 0.083 0 CA-C-N 118.229 1.015 . . . . 0.0 110.535 177.567 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 6.5 ttt -66.61 118.17 51.55 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-O 118.555 -0.736 . . . . 0.0 110.273 -179.119 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -64.45 160.02 41.43 Favored 'Trans proline' 0 N--CA 1.499 1.795 0 CA-C-N 120.471 1.204 . . . . 0.0 111.663 177.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 63.0 t30 -95.39 111.13 23.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.85 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 8.3 mt -74.23 136.92 75.41 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 118.55 -0.738 . . . . 0.0 109.532 178.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -79.13 139.57 15.12 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 CA-C-N 120.211 1.111 . . . . 0.0 111.237 174.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -97.31 125.89 43.84 Favored Pre-proline 0 CA--C 1.536 0.436 0 CA-C-O 118.473 -0.775 . . . . 0.0 110.279 178.638 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -67.41 160.37 48.09 Favored 'Trans proline' 0 N--CA 1.497 1.712 0 C-N-CA 121.165 1.243 . . . . 0.0 111.627 175.33 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.82 156.86 2.94 Favored 'Trans proline' 0 N--CA 1.497 1.686 0 C-N-CA 121.288 1.326 . . . . 0.0 111.827 178.543 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.4 tp -50.04 -29.15 8.19 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -176.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 64.9 t80 -54.94 -38.27 67.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.932 0.396 . . . . 0.0 111.164 -177.27 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1345 ' ' TRP . . . . . 0.519 ' CH2' HD13 ' A' ' 102' ' ' ILE . 35.7 t90 -60.6 -48.2 82.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.206 -177.649 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -61.48 -48.18 82.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.965 0.412 . . . . 0.0 110.67 -176.737 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -60.0 -46.11 90.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.819 -176.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -58.08 -46.31 85.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.693 -175.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -61.56 -51.36 68.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.904 -176.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -58.95 -40.07 83.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.343 -174.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 68.7 tttt -69.12 -52.47 27.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.494 -177.334 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -55.6 -49.11 73.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.442 -175.82 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -70.8 -36.99 73.25 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.256 -178.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -63.34 146.11 54.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.857 0.36 . . . . 0.0 110.63 -179.44 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 78.8 mt . . . . . 0 C--O 1.219 -0.524 0 CA-C-O 118.065 -0.969 . . . . 0.0 110.547 179.711 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.381 0 N-CA-C 110.614 -0.995 . . . . 0.0 110.614 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -66.02 130.65 24.88 Favored 'Trans proline' 0 N--CA 1.497 1.706 0 CA-C-N 119.285 1.543 . . . . 0.0 111.968 -175.853 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -58.63 -40.68 84.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.782 -179.92 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 72.1 mtm -90.6 161.58 15.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.644 -179.401 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -57.32 153.85 11.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.555 -179.973 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -58.46 141.75 50.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.54 -179.72 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 28.4 tp -57.05 -39.64 75.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.898 -179.884 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.5 ttm -84.85 120.0 25.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.733 -179.248 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -143.76 83.93 1.77 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.326 179.112 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -78.99 140.1 38.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.841 -178.428 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.4 mp0 -67.12 -30.56 70.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.59 178.394 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 24.7 m -55.27 -38.6 68.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.823 0.344 . . . . 0.0 110.857 -178.414 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.4 mm -59.52 -46.85 92.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.991 0.424 . . . . 0.0 110.041 -179.005 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.4 m -58.68 -44.38 90.21 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.15 0.5 . . . . 0.0 110.449 -178.339 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -59.2 -45.32 91.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.644 -178.571 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 89.6 mtp -58.29 -42.84 87.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.996 0.426 . . . . 0.0 110.463 -178.221 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -59.26 -49.44 77.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.027 0.441 . . . . 0.0 110.146 -178.925 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.707 ' HA ' HD12 ' A' ' 14' ' ' ILE . 14.1 tp -61.31 -30.36 70.45 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.36 -179.609 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.98 -49.91 72.85 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 122.224 -0.298 . . . . 0.0 110.579 177.862 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.94 -41.55 83.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.963 0.411 . . . . 0.0 110.464 178.422 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.72 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 92.6 mt -54.16 -53.03 32.1 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.748 179.23 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.6 mttp -53.8 -27.64 30.47 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -178.134 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -60.46 -32.2 71.18 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -176.503 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.513 HG21 ' CE2' ' A' ' 66' ' ' PHE . 47.3 mm -107.4 -41.08 5.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.864 0.364 . . . . 0.0 110.44 -176.031 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -115.13 83.36 9.83 Favored Pre-proline 0 CA--C 1.534 0.332 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.206 -178.691 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -53.65 -20.8 17.58 Favored 'Trans proline' 0 N--CA 1.498 1.759 0 C-N-CA 121.505 1.47 . . . . 0.0 113.422 -176.254 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -99.23 22.03 11.08 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.756 0.651 . . . . 0.0 112.756 -175.225 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -110.57 127.36 55.18 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 173.262 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.5 ' O ' HD21 ' A' ' 11' ' ' LEU . 16.7 pttp -122.99 -24.54 4.74 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -175.788 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.3 tp10 -127.77 140.26 52.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.726 0.298 . . . . 0.0 110.594 -179.768 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.486 HG13 HD13 ' A' ' 11' ' ' LEU . 52.6 mt -98.1 132.17 43.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.341 -0.39 . . . . 0.0 109.998 174.239 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.1 t -92.87 -47.13 13.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.173 179.938 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.499 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.9 t0 -155.02 156.31 35.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.038 178.69 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.4 p -143.03 131.98 22.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.098 0.475 . . . . 0.0 111.125 179.683 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.3 t -107.22 125.91 51.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.663 177.39 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 87.3 p -54.33 -37.77 65.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.309 -172.255 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -151.84 126.62 9.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.146 0.498 . . . . 0.0 111.688 -178.997 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.428 HG21 ' HB3' ' A' ' 52' ' ' PHE . 99.2 t -145.26 140.17 22.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.474 -177.713 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.15 149.88 50.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.147 -178.067 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.464 ' HD1' HG21 ' A' ' 46' ' ' THR . 32.3 t80 -97.89 133.62 42.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.187 0.518 . . . . 0.0 111.749 -176.383 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.406 ' CD2' HD11 ' B' 1338 ' ' LEU . 31.5 m-85 -126.56 142.0 51.68 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.467 178.973 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.606 HG23 ' CZ ' ' A' ' 103' ' ' ARG . 82.0 m -120.47 146.77 45.92 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.818 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -108.48 131.94 54.31 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.988 0.423 . . . . 0.0 110.471 176.125 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 -104.37 115.98 31.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.962 177.51 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 87.9 p -69.06 -31.46 70.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.064 -176.816 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.2 t -60.9 -39.84 90.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.763 0.316 . . . . 0.0 110.876 -177.58 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -94.43 -21.38 18.96 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -178.703 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.8 t30 69.79 43.62 0.93 Allowed 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.355 0.598 . . . . 0.0 109.748 -177.922 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -151.26 162.9 40.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.103 -177.77 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.457 ' CB ' HD12 ' B' 1338 ' ' LEU . 88.0 m95 -94.76 142.53 27.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.373 177.639 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -124.34 126.69 46.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 0.0 109.905 175.527 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 38.8 tttp -73.95 139.81 45.13 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.394 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.464 HG21 ' HD1' ' A' ' 33' ' ' PHE . 67.2 p -92.4 171.89 8.75 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.153 -178.365 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -83.75 12.49 5.88 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 178.681 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.5 t -102.43 106.47 19.94 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-O 120.964 0.411 . . . . 0.0 110.291 179.719 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -131.1 114.89 15.7 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 176.717 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.61 176.52 38.93 Favored Glycine 0 CA--C 1.519 0.295 0 C-N-CA 120.054 -1.069 . . . . 0.0 112.411 -169.67 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.489 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -81.26 134.7 35.64 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 175.145 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.428 ' HB3' HG21 ' A' ' 31' ' ' VAL . 5.4 t80 -98.3 127.57 44.3 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.079 -176.473 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.489 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.0 m-85 -131.84 142.27 49.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.276 177.654 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.689 HD11 HG23 ' A' ' 116' ' ' ILE . 68.5 mt -101.59 127.71 54.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 172.308 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.72 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.3 m-30 -108.47 136.86 47.38 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.838 0.352 . . . . 0.0 111.216 -175.922 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 68.2 t60 -114.68 141.64 47.55 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.34 175.295 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -142.31 146.93 35.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.835 176.459 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -86.77 28.09 0.92 Allowed 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.998 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.37 172.8 17.69 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.765 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -64.04 124.68 86.07 Favored Pre-proline 0 CA--C 1.539 0.535 0 CA-C-O 118.55 -0.738 . . . . 0.0 110.081 -178.129 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -79.11 140.98 60.46 Favored 'Cis proline' 0 N--CA 1.495 1.609 0 CA-C-N 121.79 1.675 . . . . 0.0 111.537 -1.677 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -63.73 -46.37 85.67 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.922 -177.613 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -142.37 136.22 29.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.274 0.559 . . . . 0.0 110.664 -177.46 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.3 t -150.26 151.33 32.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.454 -177.396 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.461 HG13 HD11 ' A' ' 80' ' ' ILE . 50.1 mt -110.86 139.51 34.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -179.228 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.513 ' CE2' HG21 ' A' ' 17' ' ' ILE . 62.9 t80 -131.83 142.06 49.61 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.81 -176.796 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 60.9 mt -123.82 127.31 73.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.214 0.531 . . . . 0.0 109.813 172.463 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 -94.25 99.54 11.76 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.011 -0.995 . . . . 0.0 109.445 -179.756 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.8 t-20 -74.48 105.75 5.76 Favored 'General case' 0 C--N 1.332 -0.165 0 O-C-N 123.728 0.642 . . . . 0.0 110.951 -175.474 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -71.84 -42.11 67.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.602 -170.879 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.8 mt -73.32 -45.17 56.88 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.781 -173.794 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 52.3 m-20 -95.07 -3.42 48.19 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -175.573 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.1 m 53.04 42.76 32.25 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.493 0.663 . . . . 0.0 111.039 177.095 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.1 m -128.49 132.68 48.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.585 -178.146 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 86.8 p -76.66 130.71 38.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.412 -179.296 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -118.0 122.26 42.74 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 172.965 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.427 HG22 ' HD2' ' A' ' 66' ' ' PHE . 31.4 t -125.55 146.39 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-O 120.745 0.307 . . . . 0.0 110.764 -176.399 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -147.88 126.37 6.09 Favored Pre-proline 0 CA--C 1.539 0.526 0 CA-C-O 118.633 -0.699 . . . . 0.0 110.43 173.836 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -75.47 150.91 36.83 Favored 'Trans proline' 0 N--CA 1.499 1.83 0 C-N-CA 121.453 1.435 . . . . 0.0 112.282 177.682 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.461 HD11 HG13 ' A' ' 65' ' ' ILE . 68.3 mt -93.21 134.64 30.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.229 177.715 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.1 p -132.14 158.06 42.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.702 177.401 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -94.27 34.96 4.4 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.059 -178.567 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.0 t -111.09 -21.15 12.1 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 173.79 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.9 mt -68.61 149.04 49.63 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-O 120.925 0.393 . . . . 0.0 111.379 -176.149 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -115.34 135.87 53.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.682 176.265 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 70.5 mt -114.81 155.21 27.19 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.913 0.387 . . . . 0.0 110.823 -176.963 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -148.7 142.77 25.93 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 178.317 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.6 t -103.52 109.19 20.75 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.645 -0.422 . . . . 0.0 110.919 -179.849 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -106.8 103.81 48.71 Favored Pre-proline 0 C--N 1.329 -0.318 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 171.333 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.09 141.91 49.36 Favored 'Trans proline' 0 N--CA 1.496 1.666 0 CA-C-N 120.477 1.206 . . . . 0.0 111.964 -172.126 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -89.86 11.66 58.31 Favored 'Cis proline' 0 N--CA 1.5 1.853 0 CA-C-N 121.108 1.431 . . . . 0.0 113.629 -3.613 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -90.41 168.25 12.01 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-O 120.62 0.248 . . . . 0.0 110.901 -178.365 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 54.6 tp -118.39 135.02 54.58 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 171.52 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.462 HD11 ' CG2' ' A' ' 102' ' ' ILE . 9.5 tp -126.97 139.15 53.26 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.539 0.209 . . . . 0.0 110.563 -174.487 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -143.13 148.63 36.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.986 0.422 . . . . 0.0 110.178 175.543 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 25.9 mtm180 -103.44 150.56 23.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.135 -175.854 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 -129.98 162.69 28.09 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.812 0.815 . . . . 0.0 111.221 -179.769 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 51.6 tt0 -49.51 149.55 2.27 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.72 -177.014 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 64.76 30.88 12.17 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.351 -0.841 . . . . 0.0 112.116 -179.834 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 18.2 m 66.64 35.11 5.45 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.958 0.409 . . . . 0.0 111.605 165.652 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 46.9 mtp85 -98.99 143.29 29.45 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.988 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.623 HD13 ' CH2' ' B' 1345 ' ' TRP . 75.9 mt -117.68 126.1 74.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-O 121.181 0.515 . . . . 0.0 110.055 -175.412 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.606 ' CZ ' HG23 ' A' ' 35' ' ' THR . 81.4 mmt-85 -130.95 147.35 52.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.444 178.788 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -139.66 166.42 25.6 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 -178.143 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -125.33 139.8 53.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.878 0.371 . . . . 0.0 110.516 -179.741 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 15.5 t90 -107.49 124.81 50.44 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.464 174.314 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.407 ' CD2' HG22 ' A' ' 31' ' ' VAL . 55.8 m-85 -113.84 143.34 44.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.785 0.326 . . . . 0.0 110.667 -179.481 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -51.24 -35.96 39.47 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.618 178.232 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.5 t-20 -136.04 134.4 38.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.371 179.39 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.0 t -60.79 -41.42 95.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.012 -177.654 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -59.82 -43.21 94.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.315 0.578 . . . . 0.0 110.194 178.881 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -56.78 -45.32 82.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.511 0.672 . . . . 0.0 109.966 179.05 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 42.2 t -59.94 -39.04 84.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.711 178.351 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -59.31 -45.98 89.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.914 0.388 . . . . 0.0 110.577 -177.303 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 60.4 ttm-85 -59.36 -48.45 81.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.998 0.428 . . . . 0.0 110.523 -177.923 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.689 HG23 HD11 ' A' ' 54' ' ' ILE . 30.8 mm -58.23 -45.97 88.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.058 -178.709 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 60.3 p -59.28 -43.07 92.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.665 -177.37 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.79 -44.37 94.25 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.654 -0.978 . . . . 0.0 110.654 -178.879 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.499 HD13 ' HB2' ' A' ' 26' ' ' ASP . 10.8 mt -58.4 -49.39 77.43 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.162 0.506 . . . . 0.0 110.528 -178.428 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 52.6 t -59.12 -42.63 87.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.13 -178.597 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 121' ' ' ASN . . . . . 0.405 ' HA ' HD12 ' A' ' 124' ' ' LEU . 87.4 m-20 -57.68 -41.96 82.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.795 0.331 . . . . 0.0 110.594 -178.95 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -60.84 -45.79 95.8 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.954 -0.859 . . . . 0.0 110.954 -179.806 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 58.6 mt -58.68 -42.28 88.17 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.901 0.381 . . . . 0.0 110.548 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.405 HD12 ' HA ' ' A' ' 121' ' ' ASN . 59.1 mt -60.13 -41.68 93.18 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.796 -179.38 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 25.6 pttt -88.36 2.38 52.71 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.264 0.838 . . . . 0.0 113.264 -179.208 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 90.4 p -116.09 149.22 39.32 Favored 'General case' 0 N--CA 1.461 0.102 0 CA-C-N 118.138 0.426 . . . . 0.0 110.391 179.135 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.0 ttmp? . . . . . 0 C--O 1.22 -0.448 0 CA-C-O 117.923 -1.037 . . . . 0.0 110.542 -179.546 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -49.38 142.68 22.06 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 121.325 1.35 . . . . 0.0 112.045 179.976 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -99.53 124.88 45.11 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.521 179.97 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 36.4 t0 -83.18 126.21 72.68 Favored Pre-proline 0 CA--C 1.537 0.443 0 CA-C-O 118.491 -0.766 . . . . 0.0 109.921 -179.897 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -73.36 -30.09 10.58 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 121.143 1.229 . . . . 0.0 112.402 179.567 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 28.0 tp -56.21 -40.05 73.42 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.84 -179.554 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.6 mt -92.42 140.89 29.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.563 -179.99 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -99.52 135.8 40.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.534 179.875 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -60.49 -40.45 91.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.781 -179.923 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -130.21 125.16 34.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.476 179.915 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 49.3 ttt85 -113.15 149.09 34.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.391 179.922 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -56.37 153.81 18.52 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.742 -179.263 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -54.71 157.13 13.12 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 121.384 1.389 . . . . 0.0 112.108 -179.607 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -107.03 99.94 29.34 Favored Pre-proline 0 CA--C 1.532 0.272 0 CA-C-O 118.987 -0.53 . . . . 0.0 110.321 179.353 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -57.99 128.92 30.74 Favored 'Trans proline' 0 N--CA 1.497 1.714 0 C-N-CA 121.017 1.145 . . . . 0.0 111.471 -179.993 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 99.59 -5.04 58.35 Favored Glycine 0 CA--C 1.536 1.395 0 C-N-CA 121.25 -0.5 . . . . 0.0 113.364 -179.248 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -55.13 145.45 21.05 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 118.183 0.991 . . . . 0.0 110.858 178.953 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 7.7 ttp -61.15 143.51 92.29 Favored Pre-proline 0 CA--C 1.533 0.314 0 CA-C-O 119.067 -0.492 . . . . 0.0 110.058 -179.319 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -59.45 149.23 82.97 Favored 'Trans proline' 0 N--CA 1.497 1.69 0 C-N-CA 121.241 1.294 . . . . 0.0 111.721 177.671 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 26.2 m120 -106.28 113.85 27.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.729 -179.555 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1338 ' ' LEU . . . . . 0.457 HD12 ' CB ' ' A' ' 43' ' ' TRP . 13.1 mt -80.34 153.8 74.15 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.255 -0.429 . . . . 0.0 109.941 178.193 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -79.01 139.75 15.44 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 121.172 1.248 . . . . 0.0 111.343 174.986 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -97.08 125.97 44.01 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-O 118.451 -0.785 . . . . 0.0 109.886 179.901 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -78.13 161.88 29.11 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 121.258 1.305 . . . . 0.0 111.868 176.177 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -50.86 150.01 13.54 Favored 'Trans proline' 0 N--CA 1.494 1.524 0 C-N-CA 121.293 1.329 . . . . 0.0 111.642 177.811 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 81.0 mt -49.91 -28.36 6.56 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -176.611 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 68.3 t80 -55.37 -38.39 68.76 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.859 0.361 . . . . 0.0 111.173 -176.923 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1345 ' ' TRP . . . . . 0.623 ' CH2' HD13 ' A' ' 102' ' ' ILE . 9.2 t90 -60.6 -48.06 83.46 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.301 -176.57 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -64.0 -48.5 76.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.898 0.38 . . . . 0.0 110.863 -176.983 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.36 -45.47 91.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.87 -176.326 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -59.75 -47.33 86.1 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.612 -176.424 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.12 -46.93 87.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.032 0.444 . . . . 0.0 110.753 -177.436 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1350 ' ' GLN . . . . . 0.473 ' O ' ' HB3' ' B' 1354 ' ' ALA . 62.0 tt0 -60.23 -44.39 95.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.286 -176.284 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 96.3 mttt -63.22 -46.9 84.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.188 -177.06 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -58.34 -49.01 78.73 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.059 -178.193 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -90.18 15.06 10.99 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 179.464 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1354 ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' B' 1350 ' ' GLN . . . -167.4 123.05 1.08 Allowed 'General case' 0 C--O 1.231 0.13 0 CA-C-O 120.838 0.351 . . . . 0.0 110.585 179.362 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 79.8 mt . . . . . 0 C--O 1.221 -0.411 0 CA-C-O 117.911 -1.042 . . . . 0.0 110.405 179.714 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 90.7 p . . . . . 0 CA--C 1.527 0.067 0 CA-C-O 120.898 0.38 . . . . 1.49 110.725 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.4 mm -60.07 -46.3 94.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.279 -0.419 . . . . 0.54 110.182 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 36.2 m -58.85 -44.91 91.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.3 -0.409 . . . . 0.44 110.369 -177.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -59.22 -45.24 91.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.096 -0.502 . . . . 3.48 110.594 -178.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 96.9 mmm -58.2 -43.37 87.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.034 0.445 . . . . 1.56 110.417 -178.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.9 m120 -60.03 -49.46 77.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.156 -0.475 . . . . 1.04 110.202 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.747 ' HA ' HD12 ' A' ' 14' ' ' ILE . 14.4 tp -61.49 -30.07 70.38 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.593 -0.443 . . . . 0.26 111.368 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.05 -50.45 70.6 Favored 'General case' 0 C--N 1.333 -0.142 0 O-C-N 122.281 -0.262 . . . . 0.26 110.551 177.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.94 -42.01 84.01 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.078 0.466 . . . . 0.2 110.373 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.747 HD12 ' HA ' ' A' ' 11' ' ' LEU . 97.6 mt -54.05 -53.08 30.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.692 -0.685 . . . . 0.2 110.66 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 54.2 mttm -53.1 -26.46 16.51 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.551 0.574 . . . . 1.46 112.551 -178.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -59.49 -33.18 71.01 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 111.904 0.335 . . . . 3.34 111.904 -177.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 48.8 mm -104.48 -44.3 8.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.047 0.451 . . . . 0.32 110.089 -177.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -114.7 85.43 11.42 Favored Pre-proline 0 CA--C 1.534 0.338 0 CA-C-N 115.707 -0.679 . . . . 0.32 110.236 -176.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.07 -21.68 13.1 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 C-N-CA 121.399 1.399 . . . . 0.59 113.42 -176.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.0 p90 -100.01 17.2 21.62 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.347 0.869 . . . . 1.35 113.347 -174.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.408 ' HB3' HG22 ' A' ' 14' ' ' ILE . . . -94.31 118.97 32.38 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 109.09 -0.707 . . . . 0.35 109.09 173.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.488 ' O ' HD21 ' A' ' 11' ' ' LEU . 76.4 tttt -108.8 -37.78 5.79 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 120.835 -0.346 . . . . 2.95 111.513 -172.084 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -128.33 147.96 50.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.873 0.368 . . . . 1.78 110.979 -176.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.506 HG13 HD13 ' A' ' 11' ' ' LEU . 58.7 mt -102.98 131.77 50.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.009 -0.542 . . . . 0.25 109.926 173.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.8 t -92.1 -47.22 14.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.916 0.389 . . . . 0.16 110.031 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -155.9 156.17 34.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.028 -0.533 . . . . 0.13 110.059 178.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 59.7 p -142.5 132.0 23.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.936 0.398 . . . . 0.15 110.58 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.2 t -106.52 129.72 54.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.925 -0.579 . . . . 0.19 109.797 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 30.2 m -54.2 -38.7 65.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.715 -0.675 . . . . 1.31 111.251 -172.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -152.72 127.8 9.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.178 0.513 . . . . 0.3 111.598 -178.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.404 HG21 ' HB3' ' A' ' 52' ' ' PHE . 99.3 t -145.19 143.85 21.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.004 -0.998 . . . . 0.09 109.539 -177.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -131.15 149.82 52.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.562 -0.29 . . . . 0.13 111.094 -178.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -99.2 131.48 45.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.277 0.56 . . . . 1.47 111.507 -177.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -127.44 143.91 51.13 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 115.946 -0.57 . . . . 0.35 110.823 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 86.4 m -121.89 148.56 44.58 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.24 -0.652 . . . . 0.25 109.24 177.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -109.45 131.95 54.59 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.999 0.428 . . . . 1.11 110.441 176.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 -103.78 114.17 28.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.878 -0.601 . . . . 0.44 109.718 176.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 86.6 p -68.92 -30.3 68.73 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.903 -0.59 . . . . 1.36 112.196 -176.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.8 p -62.4 -39.17 92.37 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.686 0.279 . . . . 1.47 110.932 -177.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -94.5 -21.51 18.84 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.607 0.595 . . . . 2.0 112.607 -179.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 69.82 44.49 0.84 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 121.414 0.626 . . . . 1.3 109.652 -177.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -149.87 160.87 43.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.614 -0.721 . . . . 1.93 111.09 -177.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 80.7 m95 -94.66 140.76 29.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.085 -0.507 . . . . 0.3 110.379 177.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -122.87 129.08 51.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.274 -0.421 . . . . 2.3 110.039 177.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 72.9 tttt -76.84 140.39 40.63 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.948 -0.39 . . . . 2.6 109.948 178.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.1 p -92.34 176.0 6.64 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.723 -0.391 . . . . 0.32 110.131 -179.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -86.17 12.94 8.66 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.638 0.607 . . . . 2.17 112.638 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.8 t -106.94 106.42 20.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-O 120.916 0.389 . . . . 0.33 110.381 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -130.39 113.02 13.82 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.575 -0.898 . . . . 0.29 108.575 174.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.66 176.48 38.97 Favored Glycine 0 CA--C 1.52 0.376 0 C-N-CA 120.191 -1.004 . . . . 0.1 112.361 -168.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.461 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -79.37 136.15 36.91 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.9 -0.778 . . . . 0.09 108.9 174.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.404 ' HB3' HG21 ' A' ' 31' ' ' VAL . 4.9 t80 -101.94 127.23 48.87 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.96 -0.296 . . . . 0.1 110.388 -175.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.461 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 6.3 m-85 -130.61 142.19 50.45 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.785 0.326 . . . . 0.11 110.647 177.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.657 HD11 HG23 ' A' ' 116' ' ' ILE . 68.1 mt -101.55 127.1 55.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.241 -0.652 . . . . 0.16 109.241 171.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.688 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 13.8 m-30 -108.58 138.17 45.32 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.015 0.436 . . . . 0.21 111.285 -177.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 68.2 t60 -111.5 143.38 42.45 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.359 -0.837 . . . . 0.26 110.213 175.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -139.51 147.11 40.81 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.873 -0.603 . . . . 2.62 110.002 178.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -86.92 28.13 0.93 Allowed 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.15 -0.477 . . . . 1.26 112.136 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.52 160.79 38.57 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.735 -0.468 . . . . 0.36 109.735 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -63.98 131.16 94.87 Favored Pre-proline 0 CA--C 1.54 0.581 0 CA-C-O 118.483 -0.77 . . . . 2.53 110.059 -176.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -71.79 140.86 67.96 Favored 'Cis proline' 0 N--CA 1.498 1.752 0 CA-C-N 121.734 1.655 . . . . 0.63 111.58 -1.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -63.95 -40.43 96.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.278 -0.419 . . . . 1.34 111.079 -177.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.472 ' HB3' HD12 ' A' ' 80' ' ' ILE . 77.7 m80 -142.65 141.35 31.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.589 0.709 . . . . 0.3 111.044 -176.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.3 t -149.19 151.55 34.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.595 -0.729 . . . . 0.19 110.02 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.419 HG13 HD11 ' A' ' 80' ' ' ILE . 57.0 mt -115.62 138.98 44.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.43 . . . . 0.2 109.883 -177.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -131.85 142.14 49.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.787 -0.642 . . . . 1.27 111.1 -177.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.4 mt -120.33 128.99 76.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-O 121.235 0.54 . . . . 0.16 109.578 171.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -94.73 99.5 11.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.022 -0.99 . . . . 0.11 109.191 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.3 t-20 -72.53 105.84 4.36 Favored 'General case' 0 C--N 1.333 -0.138 0 O-C-N 123.65 0.594 . . . . 0.19 111.031 -174.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -73.87 -40.96 62.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.836 -0.62 . . . . 3.41 111.252 -171.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 70.9 mt -70.81 -45.23 64.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.359 -0.382 . . . . 0.29 111.644 -175.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 62.3 m-20 -95.06 -3.33 48.41 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 113.761 1.023 . . . . 1.89 113.761 -175.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.438 HG22 ' O ' ' A' ' 73' ' ' THR . 14.5 m 55.88 43.41 27.57 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-O 121.521 0.677 . . . . 1.18 110.49 177.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 34.5 m -127.45 148.87 50.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.441 -0.799 . . . . 0.39 110.618 -178.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.1 p -100.82 131.95 46.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.09 -0.505 . . . . 0.61 110.88 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -128.57 122.18 30.44 Favored 'General case' 0 N--CA 1.462 0.175 0 N-CA-C 110.204 -0.295 . . . . 1.38 110.204 175.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 p -125.57 149.95 30.59 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 116.358 -0.383 . . . . 1.25 111.004 -177.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -149.35 136.86 11.26 Favored Pre-proline 0 CA--C 1.538 0.488 0 CA-C-O 119.053 -0.499 . . . . 1.81 110.755 174.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.39 150.91 37.19 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 121.691 1.594 . . . . 0.28 112.378 178.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.472 HD12 ' HB3' ' A' ' 63' ' ' HIS . 64.4 mt -89.39 123.76 41.77 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 C-N-CA 120.657 -0.417 . . . . 0.25 110.47 178.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 40.4 p -99.35 159.02 15.31 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.073 -0.512 . . . . 0.55 110.065 175.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -98.41 7.75 61.94 Favored Glycine 0 CA--C 1.534 1.231 0 C-N-CA 120.97 -0.633 . . . . 0.5 113.597 -178.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.8 p -98.76 -5.31 31.56 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 117.947 0.873 . . . . 1.31 112.932 177.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.5 mt -68.99 141.18 54.98 Favored 'General case' 0 C--O 1.232 0.143 0 O-C-N 122.062 -0.398 . . . . 0.89 111.47 -177.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 57.2 tt0 -112.08 135.83 52.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.086 -0.507 . . . . 0.66 109.638 175.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.478 HD12 ' ND2' ' A' ' 121' ' ' ASN . 69.4 mt -113.84 158.38 21.1 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.03 0.443 . . . . 0.26 111.25 -175.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -148.71 145.68 27.78 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.814 -0.81 . . . . 0.66 108.814 176.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.1 t -114.63 109.3 18.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.009 0.433 . . . . 0.3 111.433 -177.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -106.82 103.54 47.61 Favored Pre-proline 0 CA--C 1.532 0.262 0 N-CA-C 108.672 -0.862 . . . . 1.29 108.672 169.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 91' ' ' PRO . 23.2 Cg_endo -62.08 141.86 90.29 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 CA-C-N 120.593 1.248 . . . . 0.51 111.457 -171.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 90' ' ' PRO . 89.4 Cg_endo -95.38 14.48 41.32 Favored 'Cis proline' 0 N--CA 1.497 1.724 0 CA-C-N 121.143 1.444 . . . . 0.45 113.649 -3.245 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -107.45 136.64 46.9 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 122.525 -0.11 . . . . 1.29 110.896 -175.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.464 HD22 ' OG ' ' A' ' 117' ' ' SER . 36.5 tp -92.93 136.58 33.12 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 120.503 -0.479 . . . . 0.23 110.63 -176.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.5 HD11 ' CG2' ' A' ' 102' ' ' ILE . 8.7 tp -124.02 139.64 53.75 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.068 -0.515 . . . . 0.26 110.324 -173.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.1 p90 -143.96 153.95 42.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.822 0.344 . . . . 1.23 110.586 176.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 27.0 mtm105 -101.98 146.82 27.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.103 -0.499 . . . . 1.56 110.606 -178.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 16.5 t30 -129.97 168.43 16.69 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.667 0.746 . . . . 1.66 111.552 -177.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -47.08 145.8 2.01 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.566 -0.743 . . . . 2.32 112.233 -176.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 60.3 mtp180 63.82 30.91 14.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.168 -0.924 . . . . 3.51 112.146 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.2 m 65.19 35.12 8.01 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.949 0.404 . . . . 1.3 111.524 167.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 36.2 mtp180 -98.28 151.98 19.91 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.307 -0.627 . . . . 2.68 109.307 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.669 HD13 ' CH2' ' B' 1345 ' ' TRP . 72.3 mt -117.12 127.52 74.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 121.153 0.502 . . . . 0.23 110.068 -176.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 81.0 mtt85 -138.41 150.33 46.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.66 -0.7 . . . . 1.75 109.495 178.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.7 168.77 26.26 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 120.787 -0.72 . . . . 0.2 111.81 -176.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -125.27 135.02 52.1 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.279 -0.46 . . . . 1.45 110.269 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 46.5 t90 -107.46 131.01 54.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.012 -0.54 . . . . 0.78 109.899 177.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -117.17 149.77 39.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.792 0.329 . . . . 1.18 110.602 -179.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -52.63 -37.71 58.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.137 -0.483 . . . . 1.21 111.441 176.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.5 t-20 -131.28 135.2 47.1 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.467 -0.333 . . . . 0.33 110.53 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.7 t -61.97 -41.99 98.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.271 -0.422 . . . . 1.38 111.084 -177.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -60.03 -43.68 95.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.432 0.634 . . . . 0.97 110.096 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -56.43 -44.59 80.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.635 -0.711 . . . . 0.14 109.996 178.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 38.0 t -59.83 -38.5 82.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.494 -0.775 . . . . 0.24 110.732 177.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -59.11 -46.32 88.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.917 0.389 . . . . 1.63 110.527 -177.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 -59.54 -49.17 78.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.141 0.496 . . . . 3.38 110.599 -177.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.657 HG23 HD11 ' A' ' 54' ' ' ILE . 27.5 mm -58.49 -46.51 89.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.42 0.629 . . . . 0.13 109.973 -178.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.464 ' OG ' HD22 ' A' ' 93' ' ' LEU . 20.9 m -58.65 -40.9 84.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.97 -0.559 . . . . 0.76 110.682 -177.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -56.9 -42.43 92.34 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 110.688 -0.965 . . . . 0.18 110.688 -179.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.545 HD12 ' HA ' ' A' ' 116' ' ' ILE . 16.0 mt -57.79 -50.05 74.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.438 0.637 . . . . 0.18 110.275 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 53.1 t -58.46 -43.62 87.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.546 -0.752 . . . . 0.23 110.109 -177.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.478 ' ND2' HD12 ' A' ' 86' ' ' LEU . 24.4 m120 -57.45 -41.51 80.65 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.3 -0.409 . . . . 1.04 110.634 -178.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.43 -45.63 95.5 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 111.184 -0.766 . . . . 0.29 111.184 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 66.8 mt -57.89 -41.7 83.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.899 0.38 . . . . 0.33 110.621 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 88.5 mt . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.007 -0.542 . . . . 0.55 110.749 -179.296 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 8.4 mt . . . . . 0 CA--C 1.53 0.197 0 N-CA-C 109.59 -0.522 . . . . 0.51 109.59 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -79.06 139.79 15.37 Favored 'Trans proline' 0 N--CA 1.492 1.386 0 C-N-CA 121.057 1.171 . . . . 0.6 111.08 174.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -97.17 125.78 44.54 Favored Pre-proline 0 CA--C 1.535 0.391 0 CA-C-O 118.512 -0.756 . . . . 2.42 109.955 179.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -78.18 169.04 20.9 Favored 'Trans proline' 0 N--CA 1.497 1.721 0 C-N-CA 121.311 1.34 . . . . 0.7 112.015 176.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -65.18 157.08 59.46 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 121.328 1.352 . . . . 0.67 111.396 176.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 9.8 tt -50.0 -32.82 16.14 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.131 0.419 . . . . 1.84 112.131 -176.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 58.4 t80 -54.28 -36.16 63.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.85 0.357 . . . . 3.35 111.418 -176.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B 1345 ' ' TRP . . . . . 0.669 ' CH2' HD13 ' A' ' 102' ' ' ILE . 12.1 t90 -61.75 -48.18 81.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.37 -0.377 . . . . 0.37 110.448 -176.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -62.45 -47.93 81.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.042 0.449 . . . . 1.82 110.574 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -59.45 -44.49 92.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.142 -0.481 . . . . 2.4 110.905 -177.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -59.03 -46.39 88.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.249 -0.432 . . . . 1.53 110.654 -176.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.53 -48.0 83.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.113 0.482 . . . . 0.43 110.631 -177.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 115.974 -0.557 . . . . 2.09 111.141 -176.818 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.6 p . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.89 0.376 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mm -60.39 -47.18 93.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.0 0.429 . . . . 0.0 110.211 -178.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.6 m -58.94 -43.88 91.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.565 -177.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.0 mtp85 -59.75 -44.95 93.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.626 -178.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 97.2 mmm -58.24 -43.92 88.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.005 0.431 . . . . 0.0 110.425 -178.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -60.7 -49.69 76.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.271 -178.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.657 ' HA ' HD12 ' A' ' 14' ' ' ILE . 10.6 tp -59.33 -32.9 70.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.05 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.69 -50.68 68.26 Favored 'General case' 0 C--N 1.332 -0.166 0 O-C-N 122.294 -0.254 . . . . 0.0 110.906 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.75 -41.71 82.45 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.99 0.424 . . . . 0.0 110.502 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.657 HD12 ' HA ' ' A' ' 11' ' ' LEU . 94.9 mt -54.18 -53.07 31.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.715 177.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -52.88 -21.34 4.16 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -57.91 -35.4 71.01 Favored 'General case' 0 C--N 1.332 -0.169 0 O-C-N 122.33 -0.231 . . . . 0.0 111.477 -177.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.656 HG21 ' HB2' ' A' ' 75' ' ' SER . 45.8 mm -113.01 -39.78 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-O 120.776 0.322 . . . . 0.0 110.554 -177.202 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -117.29 77.2 9.65 Favored Pre-proline 0 CA--C 1.535 0.367 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.162 -178.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -55.69 -21.49 32.13 Favored 'Trans proline' 0 N--CA 1.498 1.738 0 C-N-CA 121.512 1.475 . . . . 0.0 113.396 -175.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -88.69 8.76 27.04 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -174.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -86.81 124.77 33.42 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 174.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.594 ' O ' HD21 ' A' ' 11' ' ' LEU . 67.7 mttm -105.61 -39.35 6.12 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.798 0.332 . . . . 0.0 111.173 -174.025 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -134.72 144.78 47.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.97 0.414 . . . . 0.0 111.064 -176.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.405 HD11 HD12 ' A' ' 14' ' ' ILE . 24.4 mt -96.34 131.32 43.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 172.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.1 t -91.49 -47.19 14.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 0.0 109.929 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.492 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -153.03 152.01 30.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.844 178.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.9 p -139.86 131.94 27.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.083 0.468 . . . . 0.0 110.958 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 45.0 t -105.37 126.9 52.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.654 176.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.1 m -54.4 -38.9 66.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.191 -172.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -151.31 127.04 10.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.217 0.532 . . . . 0.0 111.501 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.464 HG22 ' CD2' ' A' ' 107' ' ' PHE . 96.5 t -144.91 142.31 22.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.526 -177.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -131.53 149.87 52.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.203 -178.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.438 ' HD2' HG21 ' A' ' 46' ' ' THR . 20.5 t80 -100.68 131.33 46.64 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.656 -176.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -127.16 144.45 51.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.819 178.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 74.7 m -122.46 149.48 43.81 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -109.48 131.93 54.61 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.854 0.359 . . . . 0.0 110.316 175.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.0 t-20 -103.92 114.7 29.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.73 176.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 84.8 p -68.6 -31.41 70.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.058 -177.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.2 m -61.91 -38.61 89.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.686 0.279 . . . . 0.0 110.964 -177.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -95.1 -21.44 18.54 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -178.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 51.0 t30 68.95 45.65 0.92 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-O 121.411 0.624 . . . . 0.0 109.343 -177.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 76.8 tt0 -151.49 150.58 30.54 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.281 -176.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 78.2 m95 -85.32 138.46 32.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.871 175.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -122.05 126.39 48.37 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 177.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -73.8 139.71 45.35 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 177.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.438 HG21 ' HD2' ' A' ' 33' ' ' PHE . 69.7 p -92.31 175.42 6.85 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.181 -178.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.6 p30 -86.51 13.71 7.98 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.1 t -108.5 106.42 20.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 121.047 0.451 . . . . 0.0 110.342 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -131.49 112.1 12.36 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 174.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.64 176.56 38.95 Favored Glycine 0 CA--C 1.522 0.48 0 C-N-CA 120.125 -1.036 . . . . 0.0 112.283 -168.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.491 ' HB2' HH21 ' A' ' 70' ' ' ARG . . . -77.47 135.85 38.3 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 174.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -103.04 126.96 50.45 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.368 -175.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.475 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 5.0 m-85 -130.04 142.07 50.66 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.744 0.307 . . . . 0.0 110.72 177.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.59 HD11 HG23 ' A' ' 116' ' ' ILE . 68.3 mt -101.59 126.9 55.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 171.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.62 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 14.2 m-30 -108.65 138.56 44.77 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.995 0.426 . . . . 0.0 111.552 -177.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -108.82 143.34 38.13 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.976 173.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -140.49 146.34 38.05 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.111 178.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -86.88 28.11 0.93 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 112.1 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.97 162.77 38.22 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -63.91 129.88 94.13 Favored Pre-proline 0 CA--C 1.539 0.528 0 CA-C-O 118.448 -0.787 . . . . 0.0 110.002 -177.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -73.46 140.93 70.01 Favored 'Cis proline' 0 N--CA 1.498 1.793 0 CA-C-N 121.867 1.703 . . . . 0.0 111.681 -1.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -63.09 -40.73 98.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.925 -177.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.475 ' HB3' HD12 ' A' ' 80' ' ' ILE . 77.9 m80 -143.02 140.51 31.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.401 0.619 . . . . 0.0 110.944 -177.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.5 t -149.81 152.31 34.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.281 -178.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.428 HG13 HD11 ' A' ' 80' ' ' ILE . 53.1 mt -116.13 138.65 45.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 -177.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -131.87 142.09 49.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.135 -176.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.6 mt -121.05 131.47 72.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.186 0.517 . . . . 0.0 109.833 172.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -98.71 99.56 10.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.902 -1.044 . . . . 0.0 109.335 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.4 t-20 -73.2 107.71 5.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.271 0.558 . . . . 0.0 111.268 -174.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.491 HH21 ' HB2' ' A' ' 51' ' ' ALA . 96.8 mtt180 -73.47 -39.38 64.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.272 -172.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 70.2 mt -73.23 -45.19 57.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.719 -174.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -95.05 -3.42 48.27 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.753 1.019 . . . . 0.0 113.753 -175.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.8 m 55.95 43.14 27.82 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 121.477 0.656 . . . . 0.0 110.49 177.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.8 m -130.13 149.02 52.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.332 -178.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.656 ' HB2' HG21 ' A' ' 17' ' ' ILE . 4.0 p -102.66 139.98 37.54 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.094 -179.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -134.64 122.25 22.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.185 177.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.7 p -125.55 148.49 30.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.038 -177.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 55.5 tt0 -148.66 137.07 11.62 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-O 119.063 -0.494 . . . . 0.0 110.622 175.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.53 150.95 36.63 Favored 'Trans proline' 0 N--CA 1.498 1.744 0 C-N-CA 121.67 1.58 . . . . 0.0 112.268 178.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.475 HD12 ' HB3' ' A' ' 63' ' ' HIS . 63.4 mt -89.42 121.07 39.15 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 C-N-CA 120.711 -0.395 . . . . 0.0 110.363 178.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 71.0 p -99.1 160.8 14.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.052 176.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -97.38 7.31 63.83 Favored Glycine 0 CA--C 1.533 1.215 0 C-N-CA 120.877 -0.678 . . . . 0.0 113.607 -178.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.7 p -99.04 -3.75 34.04 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 117.927 0.863 . . . . 0.0 113.015 177.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.0 mt -68.36 144.45 54.77 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 118.1 0.409 . . . . 0.0 111.166 -177.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.1 tt0 -115.97 135.84 53.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.78 176.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.403 HD12 ' OD1' ' A' ' 121' ' ' ASN . 60.0 mt -117.23 157.74 25.51 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.896 0.379 . . . . 0.0 110.854 -176.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -150.14 143.36 25.0 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.0 t -98.59 109.11 21.92 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.491 178.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.4 ' HG3' HD22 ' A' ' 94' ' ' LEU . 20.9 mm-40 -106.87 103.75 48.64 Favored Pre-proline 0 C--N 1.328 -0.329 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 172.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -70.4 143.11 46.82 Favored 'Trans proline' 0 N--CA 1.497 1.702 0 CA-C-N 120.541 1.229 . . . . 0.0 112.027 -171.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -90.94 14.59 50.13 Favored 'Cis proline' 0 N--CA 1.5 1.858 0 CA-C-N 121.041 1.407 . . . . 0.0 113.481 -3.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -95.97 172.28 8.1 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.531 0.205 . . . . 0.0 110.627 -177.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.8 tp -113.98 135.01 54.46 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 172.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.402 HD21 ' HZ2' ' B' 1345 ' ' TRP . 9.0 tp -126.02 139.19 53.62 Favored 'General case' 0 C--N 1.333 -0.114 0 N-CA-C 110.428 -0.212 . . . . 0.0 110.428 -173.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 50.8 p90 -145.97 154.43 41.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.965 0.412 . . . . 0.0 110.627 174.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.6 mtm180 -104.75 149.13 25.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.729 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -129.96 165.56 21.87 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.856 0.836 . . . . 0.0 111.549 -178.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -48.45 146.54 2.86 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.524 -0.762 . . . . 0.0 112.1 -176.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 38.8 ttp180 65.23 30.95 11.08 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.289 -0.869 . . . . 0.0 112.041 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 46.9 t 66.05 35.23 6.43 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.858 0.361 . . . . 0.0 111.538 166.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 18.7 mmm180 -97.89 148.24 23.63 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 76.9 mt -113.66 128.55 70.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -178.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -138.75 150.31 45.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.535 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.33 169.32 25.89 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 111.494 -0.642 . . . . 0.0 111.494 -175.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -125.19 139.87 53.36 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 120.951 0.405 . . . . 0.0 110.909 -177.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 65.5 t90 -106.22 125.39 50.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.533 174.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.464 ' CD2' HG22 ' A' ' 31' ' ' VAL . 67.7 m-85 -117.19 140.31 49.69 Favored 'General case' 0 C--N 1.33 -0.258 0 O-C-N 123.262 0.351 . . . . 0.0 110.539 -179.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -50.49 -39.71 49.17 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.908 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -131.72 137.26 48.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.664 0.268 . . . . 0.0 110.372 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 84.3 p -62.28 -42.28 99.21 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.144 -177.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -59.01 -44.19 91.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.431 0.634 . . . . 0.0 109.961 178.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -55.94 -44.22 78.18 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.152 178.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 49.2 t -60.07 -40.65 90.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.594 178.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -59.09 -46.1 89.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.904 0.383 . . . . 0.0 110.634 -176.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.0 mtm180 -61.04 -49.38 77.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.817 -177.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.59 HG23 HD11 ' A' ' 54' ' ' ILE . 26.8 mm -58.65 -44.3 89.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.996 0.427 . . . . 0.0 109.963 -178.433 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.8 m -59.36 -44.19 92.74 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.667 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.59 -44.36 93.92 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 -178.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.492 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.2 mt -59.03 -49.09 79.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.145 0.498 . . . . 0.0 110.607 -178.37 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 56.9 t -58.97 -42.66 86.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.164 -178.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.403 ' OD1' HD12 ' A' ' 86' ' ' LEU . 83.6 m-20 -57.74 -42.75 84.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.881 0.372 . . . . 0.0 110.552 -178.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.65 -42.28 99.73 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 -179.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.4 mt -62.69 -43.12 99.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.774 0.321 . . . . 0.0 111.105 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 65.4 mt . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.458 -176.509 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 17.7 mt . . . . . 0 CA--C 1.53 0.198 0 CA-C-O 119.354 -0.355 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.17 139.87 15.25 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 C-N-CA 121.163 1.242 . . . . 0.0 110.981 173.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 49.0 mmtt -97.11 125.76 44.74 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-O 118.892 -0.575 . . . . 0.0 109.982 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -75.8 154.13 38.58 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 121.392 1.394 . . . . 0.0 111.381 171.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -51.68 152.11 13.5 Favored 'Trans proline' 0 N--CA 1.496 1.633 0 C-N-CA 121.271 1.314 . . . . 0.0 111.621 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.3 tp -50.0 -29.74 9.23 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -177.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -55.15 -37.27 66.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.815 0.34 . . . . 0.0 111.223 -177.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B 1345 ' ' TRP . . . . . 0.402 ' HZ2' HD21 ' A' ' 94' ' ' LEU . 35.5 t90 -60.89 -48.03 83.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.181 -177.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -61.7 -49.44 76.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.088 0.471 . . . . 0.0 110.482 -177.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -59.96 -45.44 92.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.974 -176.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -59.44 -47.33 85.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.713 -175.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.73 -48.56 81.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.823 -176.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.144 -175.592 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.2 t . . . . . 0 CA--C 1.526 0.045 0 CA-C-O 120.954 0.407 . . . . 0.0 110.594 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.2 mm -59.87 -46.07 94.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.133 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.2 m -58.84 -44.71 90.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.449 -177.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -59.7 -45.13 93.05 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.66 -178.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 89.6 mtp -58.25 -42.92 87.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.996 0.427 . . . . 0.0 110.416 -178.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -60.13 -49.97 75.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.216 -178.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.75 ' HA ' HD12 ' A' ' 14' ' ' ILE . 14.2 tp -61.31 -30.5 70.54 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.631 -0.427 . . . . 0.0 111.342 -179.566 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.57 -49.78 73.89 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 122.219 -0.301 . . . . 0.0 110.505 178.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.16 -42.32 85.74 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.032 0.444 . . . . 0.0 110.336 178.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.75 HD12 ' HA ' ' A' ' 11' ' ' LEU . 95.6 mt -54.24 -52.98 33.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.755 178.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -55.62 -26.55 44.71 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -177.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 52.8 mttm -59.98 -30.82 69.37 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -177.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.9 mm -107.63 -42.49 6.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.843 0.354 . . . . 0.0 110.319 -176.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -114.7 84.6 10.35 Favored Pre-proline 0 CA--C 1.533 0.315 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.473 -176.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -53.11 -22.95 20.72 Favored 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 121.528 1.486 . . . . 0.0 113.338 -177.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.2 p90 -97.51 22.07 9.39 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 -175.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -107.89 122.4 46.72 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 171.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.476 ' O ' HD21 ' A' ' 11' ' ' LEU . 46.1 mtmt -116.71 -30.14 5.88 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -174.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -128.84 142.25 51.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.763 0.316 . . . . 0.0 110.862 -178.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.474 HG13 HD13 ' A' ' 11' ' ' LEU . 57.6 mt -98.98 132.42 44.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.85 174.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 43.6 t -94.41 -47.14 13.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.195 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.504 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.1 t0 -154.05 153.76 32.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.181 178.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.5 p -141.72 131.99 24.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.943 0.401 . . . . 0.0 110.749 178.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 38.3 t -106.98 129.15 54.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.726 176.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.8 m -54.27 -38.22 65.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.252 -172.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -152.73 126.66 9.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.141 0.496 . . . . 0.0 111.759 -178.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 99.3 t -145.19 142.64 22.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.534 -177.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.93 149.89 50.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.68 -0.236 . . . . 0.0 111.022 -179.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -98.72 132.58 43.99 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.33 0.586 . . . . 0.0 111.602 -177.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -129.54 143.94 51.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.666 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 96.5 m -121.98 149.56 43.29 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -110.91 131.99 54.58 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.997 0.427 . . . . 0.0 110.535 177.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 -104.41 114.91 29.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.811 176.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.1 m -67.84 -32.69 73.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.987 -177.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.0 t -60.27 -39.48 86.96 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.719 0.295 . . . . 0.0 110.9 -177.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -94.45 -21.42 18.92 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 26.5 t30 69.41 43.78 1.0 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.348 0.594 . . . . 0.0 109.739 -177.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.5 mt-10 -150.43 161.83 41.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.124 -177.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.439 ' CB ' HD12 ' B' 1338 ' ' LEU . 81.8 m95 -94.89 140.0 30.54 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.416 177.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -119.75 126.42 51.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.477 . . . . 0.0 109.951 176.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.9 ttpm? -74.4 140.12 44.51 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 178.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 74.3 p -92.25 176.46 6.48 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.412 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -88.36 13.39 11.81 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 45.2 t -108.1 106.42 20.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 121.03 0.443 . . . . 0.0 110.475 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -129.35 112.75 14.16 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 174.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.56 38.96 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 120.114 -1.041 . . . . 0.0 112.237 -168.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.47 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.38 136.42 37.67 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 175.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -100.91 126.28 47.53 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.178 -175.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.47 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 6.0 m-85 -129.58 142.25 50.79 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.744 0.307 . . . . 0.0 110.55 177.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.658 HD11 HG23 ' A' ' 116' ' ' ILE . 68.9 mt -101.61 126.87 55.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 171.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.683 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 14.3 m-30 -108.58 137.48 46.46 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.827 0.346 . . . . 0.0 111.229 -177.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 50.9 t60 -112.07 143.25 43.39 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.004 174.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 33.8 tpt85 -142.21 147.89 37.29 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.268 177.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -86.94 28.21 0.93 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.218 -0.447 . . . . 0.0 112.077 -179.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.02 169.79 23.77 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -64.01 125.25 87.58 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.982 -178.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -78.34 140.97 63.2 Favored 'Cis proline' 0 N--CA 1.496 1.642 0 CA-C-N 121.911 1.718 . . . . 0.0 111.843 -1.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -61.54 -42.22 98.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.903 -177.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.459 ' HB3' HD12 ' A' ' 80' ' ' ILE . 77.5 m80 -143.63 139.8 29.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.353 0.596 . . . . 0.0 110.891 -177.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.3 t -149.9 151.26 33.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.303 -177.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.442 HG13 HD11 ' A' ' 80' ' ' ILE . 48.1 mt -113.47 137.67 45.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 -178.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -131.82 142.2 49.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.355 -176.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.4 mt -120.66 130.35 74.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 121.202 0.525 . . . . 0.0 109.662 172.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -96.96 99.56 11.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.937 -1.029 . . . . 0.0 109.205 179.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -71.89 107.58 4.72 Favored 'General case' 0 C--N 1.332 -0.181 0 O-C-N 123.666 0.604 . . . . 0.0 111.089 -174.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 78.3 ttt-85 -73.33 -42.41 62.33 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.397 -171.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 48.7 mt -72.27 -45.09 61.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.633 -175.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -95.08 -3.22 48.55 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 -175.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 69.7 p 50.93 42.64 28.44 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.511 0.672 . . . . 0.0 111.183 177.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 32.4 m -127.67 135.53 50.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.334 -179.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.3 p -85.36 136.81 33.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.354 -178.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -132.71 122.17 24.2 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.347 175.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 13.2 p -125.59 150.31 30.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.209 -178.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -148.28 136.37 11.2 Favored Pre-proline 0 CA--C 1.537 0.466 0 CA-C-O 119.106 -0.473 . . . . 0.0 110.567 174.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -75.43 151.01 37.13 Favored 'Trans proline' 0 N--CA 1.498 1.774 0 C-N-CA 121.704 1.602 . . . . 0.0 112.403 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.459 HD12 ' HB3' ' A' ' 63' ' ' HIS . 64.5 mt -90.78 125.44 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.151 177.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.414 ' H ' HD11 ' A' ' 84' ' ' LEU . 40.6 p -98.49 160.29 14.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.264 176.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -82.35 -22.09 59.36 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 121.218 -0.515 . . . . 0.0 113.124 -176.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.9 p -87.02 10.15 17.39 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -177.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.414 HD11 ' H ' ' A' ' 81' ' ' THR . 76.7 mt -66.88 131.82 46.7 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 118.109 0.413 . . . . 0.0 111.098 -177.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -112.35 135.8 52.6 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.901 176.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 70.5 mt -119.23 157.83 27.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.023 0.439 . . . . 0.0 111.087 -175.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -144.08 135.71 25.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.473 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.0 t -97.72 109.33 22.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.994 0.426 . . . . 0.0 111.241 -177.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 12.6 mt-30 -106.57 129.22 24.79 Favored Pre-proline 0 CA--C 1.534 0.362 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 173.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -79.26 128.95 8.42 Favored 'Trans proline' 0 N--CA 1.494 1.551 0 CA-C-N 120.651 1.268 . . . . 0.0 111.878 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -98.71 19.25 26.22 Favored 'Cis proline' 0 N--CA 1.5 1.889 0 CA-C-N 122.121 1.793 . . . . 0.0 113.026 -6.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -112.58 132.94 54.88 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.713 0.292 . . . . 0.0 111.371 -171.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 35.5 tp -90.22 135.04 33.91 Favored 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.702 -172.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.427 HD11 ' CG2' ' A' ' 102' ' ' ILE . 7.5 tp -123.53 143.01 50.46 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.519 -175.419 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 33.8 p90 -143.38 152.27 41.4 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.835 0.35 . . . . 0.0 110.199 175.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 27.0 mtm180 -104.64 144.58 31.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.714 -176.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -129.1 167.76 17.09 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.915 0.864 . . . . 0.0 111.619 -177.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 52.1 tt0 -48.52 149.33 1.68 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.983 -176.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 62.05 30.96 18.03 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.212 -0.904 . . . . 0.0 112.172 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 7.5 m 65.11 35.29 8.04 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.842 0.354 . . . . 0.0 111.541 166.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 90.0 mtt-85 -97.48 147.02 24.66 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.65 HD13 ' CH2' ' B' 1345 ' ' TRP . 73.0 mt -115.57 124.19 71.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 -177.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 81.1 mtm180 -137.24 150.32 47.76 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -146.6 169.44 27.8 Favored Glycine 0 CA--C 1.523 0.555 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.956 -175.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -125.15 136.53 53.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.165 -0.517 . . . . 0.0 110.534 -178.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 70.4 t90 -106.57 125.82 51.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.597 176.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -113.47 146.36 39.71 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.837 0.351 . . . . 0.0 110.646 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -52.32 -36.13 52.51 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.569 177.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 33.1 t-20 -133.21 133.75 43.15 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.786 0.327 . . . . 0.0 110.491 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 22.9 m -61.21 -40.64 94.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.169 -178.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -61.0 -43.18 99.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.322 0.582 . . . . 0.0 110.189 179.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -57.0 -45.19 83.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.569 0.699 . . . . 0.0 110.032 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 46.8 t -59.58 -38.56 81.52 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.766 177.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -58.63 -45.52 89.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.888 0.375 . . . . 0.0 110.484 -177.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 64.1 mtp85 -59.74 -48.22 82.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.539 -178.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.658 HG23 HD11 ' A' ' 54' ' ' ILE . 30.5 mm -58.2 -44.97 88.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.093 0.473 . . . . 0.0 110.044 -178.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 54.3 p -59.51 -44.6 93.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.715 -177.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.51 -43.25 94.17 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.655 -0.978 . . . . 0.0 110.655 -178.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.504 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.6 mt -59.07 -49.13 79.06 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.154 0.502 . . . . 0.0 110.552 -178.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 53.2 t -58.54 -43.05 86.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.207 -177.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -58.24 -43.86 88.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.643 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.51 -38.99 96.71 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.461 -0.656 . . . . 0.0 111.461 -179.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 36.8 mt -65.3 -43.98 89.37 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.624 0.249 . . . . 0.0 111.341 179.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 40.8 mt . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.078 -176.564 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B 1338 ' ' LEU . . . . . 0.439 HD12 ' CB ' ' A' ' 43' ' ' TRP . 17.0 mt . . . . . 0 C--O 1.233 0.199 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.07 139.79 15.36 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 C-N-CA 121.091 1.194 . . . . 0.0 111.158 174.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -97.14 125.88 44.2 Favored Pre-proline 0 CA--C 1.535 0.394 0 CA-C-O 118.442 -0.79 . . . . 0.0 109.706 179.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -78.1 167.12 23.88 Favored 'Trans proline' 0 N--CA 1.496 1.63 0 CA-C-N 120.607 1.253 . . . . 0.0 111.813 177.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -61.54 156.35 47.64 Favored 'Trans proline' 0 N--CA 1.494 1.551 0 C-N-CA 121.292 1.328 . . . . 0.0 111.218 177.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 23.8 tp -49.95 -30.15 9.82 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -176.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -56.53 -36.72 69.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.762 0.315 . . . . 0.0 111.388 -176.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B 1345 ' ' TRP . . . . . 0.65 ' CH2' HD13 ' A' ' 102' ' ' ILE . 5.9 t90 -61.54 -48.19 82.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.851 0.358 . . . . 0.0 110.309 -176.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -64.88 -48.66 73.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.041 0.448 . . . . 0.0 110.863 -178.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 61.8 tt0 -58.56 -43.36 89.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.883 -176.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -59.74 -48.16 82.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.597 -176.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -58.21 -47.59 83.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.135 0.493 . . . . 0.0 110.617 -177.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.295 -176.647 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 16.6 t . . . . . 0 C--O 1.231 0.103 0 CA-C-O 121.078 0.466 . . . . 0.0 110.339 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 45.5 mm -59.54 -41.25 84.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.242 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.8 m -60.05 -45.18 93.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.881 0.372 . . . . 0.0 110.631 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 59.9 ttt85 -59.66 -46.98 87.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.993 0.425 . . . . 0.0 110.459 -178.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 86.1 mtp -58.18 -43.13 87.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.232 0.539 . . . . 0.0 110.375 -178.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -60.53 -48.3 82.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.33 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.675 ' HA ' HD12 ' A' ' 14' ' ' ILE . 8.4 tp -60.5 -33.63 72.9 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.058 -178.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.47 -50.04 73.02 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.655 0.264 . . . . 0.0 110.608 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.16 -41.36 88.19 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.005 0.431 . . . . 0.0 110.553 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.688 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 95.6 mt -54.18 -52.97 32.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.53 178.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -53.28 -25.33 14.27 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -177.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 55.6 mttm -59.72 -32.65 70.73 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -177.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.2 mm -108.86 -42.78 5.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.958 0.409 . . . . 0.0 110.253 -177.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -117.18 77.32 9.37 Favored Pre-proline 0 CA--C 1.535 0.397 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.912 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -55.35 -20.6 26.22 Favored 'Trans proline' 0 N--CA 1.498 1.774 0 C-N-CA 121.481 1.454 . . . . 0.0 113.431 -175.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.4 p90 -90.6 10.23 26.42 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -174.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.74 126.45 32.4 Favored 'General case' 0 C--O 1.231 0.097 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 175.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -97.9 -40.47 8.48 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.799 -0.361 . . . . 0.0 110.778 -176.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -153.05 156.73 39.3 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.549 -0.461 . . . . 0.0 111.565 -179.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 61.8 mt -93.16 138.1 20.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.068 177.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.2 t -90.05 -45.97 15.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.684 176.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.507 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.9 t0 -156.74 157.62 35.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.85 178.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.6 p -142.49 132.32 24.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.138 0.494 . . . . 0.0 111.205 -179.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 24.7 t -106.16 124.46 49.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.5 176.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.3 m -54.12 -38.22 65.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.302 -171.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 52.7 t-80 -150.39 126.46 10.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.19 0.519 . . . . 0.0 111.651 -178.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.454 HG21 ' HB3' ' A' ' 52' ' ' PHE . 93.4 t -145.14 138.18 21.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.403 -177.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -126.26 149.84 48.82 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.029 -178.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.407 ' HD1' HG21 ' A' ' 46' ' ' THR . 18.9 t80 -98.76 129.99 45.21 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 121.319 0.58 . . . . 0.0 111.682 -176.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -125.43 142.86 51.27 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.461 178.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 90.1 m -121.66 146.61 46.83 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -108.37 131.96 54.22 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.929 0.395 . . . . 0.0 110.395 176.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 31.3 t-20 -104.3 116.13 31.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.91 177.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 86.1 p -68.63 -31.89 71.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.966 -177.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.7 m -61.31 -39.36 90.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.777 0.322 . . . . 0.0 110.909 -177.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -93.7 -21.4 19.37 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 28.1 t30 68.96 42.95 1.22 Allowed 'General case' 0 C--O 1.232 0.134 0 CA-C-O 121.299 0.571 . . . . 0.0 109.8 -177.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -151.54 163.99 37.82 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.106 -177.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.441 ' CB ' HD12 ' B' 1338 ' ' LEU . 83.0 m95 -94.92 140.92 29.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.322 177.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -122.89 131.34 53.7 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 176.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -76.15 139.79 41.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.278 178.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.407 HG21 ' HD1' ' A' ' 33' ' ' PHE . 66.3 p -92.32 171.99 8.7 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.699 -0.401 . . . . 0.0 109.944 178.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -85.81 13.82 6.79 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 178.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.6 t -105.15 106.47 20.57 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 CA-C-O 120.959 0.409 . . . . 0.0 110.464 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -130.34 114.94 16.23 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 175.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.58 176.47 38.91 Favored Glycine 0 CA--C 1.52 0.384 0 C-N-CA 120.065 -1.064 . . . . 0.0 112.372 -169.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.465 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -81.64 135.97 35.53 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 175.374 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.454 ' HB3' HG21 ' A' ' 31' ' ' VAL . 7.2 t80 -99.55 128.83 45.67 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.127 -176.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.465 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.2 m-85 -132.08 143.53 50.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.339 177.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.665 HD11 HG23 ' A' ' 116' ' ' ILE . 68.9 mt -101.51 128.41 53.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 171.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.688 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 14.8 m-30 -108.54 135.56 49.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.007 0.432 . . . . 0.0 111.189 -175.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -115.42 142.48 46.65 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.098 176.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -142.07 146.98 36.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.089 178.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -86.87 28.01 0.94 Allowed 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 178.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.36 165.42 34.77 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -63.89 130.34 94.4 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-O 118.563 -0.732 . . . . 0.0 110.206 -177.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -72.84 140.87 69.42 Favored 'Cis proline' 0 N--CA 1.497 1.694 0 CA-C-N 121.717 1.649 . . . . 0.0 111.331 -3.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -66.45 -43.47 85.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.025 -177.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.449 ' CD2' HD22 ' A' ' 123' ' ' LEU . 69.3 m80 -141.78 136.63 30.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.296 0.569 . . . . 0.0 110.768 -176.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.1 t -151.03 152.25 33.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.476 -178.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.466 HG13 HD11 ' A' ' 80' ' ' ILE . 43.9 mt -109.3 140.07 29.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -131.75 141.99 49.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.733 -177.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.4 mt -126.48 130.12 71.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.265 0.555 . . . . 0.0 110.076 173.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -97.81 99.86 11.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 114.946 -1.025 . . . . 0.0 109.776 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -73.27 107.12 5.41 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.802 0.689 . . . . 0.0 110.958 -176.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -71.81 -49.2 40.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.456 -171.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 44.0 mt -67.49 -45.01 77.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.519 -175.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -95.08 -3.0 48.95 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -174.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 11.5 t 44.63 41.39 4.83 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.348 0.594 . . . . 0.0 112.015 178.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 40.1 m -121.25 137.5 54.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.074 -0.967 . . . . 0.0 109.87 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 77.5 p -81.06 132.99 35.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.586 -176.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -119.66 122.16 40.88 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 174.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 38.2 t -125.53 145.81 32.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 120.68 0.276 . . . . 0.0 110.672 -177.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -148.15 126.36 5.96 Favored Pre-proline 0 CA--C 1.538 0.514 0 CA-C-O 118.621 -0.704 . . . . 0.0 110.464 173.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -75.45 150.86 36.87 Favored 'Trans proline' 0 N--CA 1.499 1.838 0 C-N-CA 121.571 1.514 . . . . 0.0 112.316 177.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.466 HD11 HG13 ' A' ' 65' ' ' ILE . 67.3 mt -94.25 135.6 28.1 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-O 120.934 0.397 . . . . 0.0 110.077 177.212 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.5 p -132.1 157.7 43.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.795 177.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -89.57 32.93 4.55 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.286 -178.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t -111.07 -20.56 12.35 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 173.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.6 mt -68.69 146.49 52.93 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.878 0.37 . . . . 0.0 111.133 -176.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -121.78 135.91 54.93 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.847 176.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 65.5 mt -113.87 159.0 20.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.698 -177.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -148.01 141.51 25.4 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 177.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.9 t -107.12 109.32 21.13 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.92 0.39 . . . . 0.0 111.209 -178.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -106.79 103.63 47.88 Favored Pre-proline 0 CA--C 1.532 0.277 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 170.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -64.03 145.32 89.53 Favored 'Trans proline' 0 N--CA 1.497 1.722 0 CA-C-N 120.523 1.223 . . . . 0.0 111.85 -170.188 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -93.95 18.43 37.95 Favored 'Cis proline' 0 N--CA 1.498 1.779 0 CA-C-N 120.904 1.358 . . . . 0.0 113.183 -3.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -110.59 159.96 17.09 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 110.342 -0.244 . . . . 0.0 110.342 -176.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 31.3 tp -110.76 133.63 53.17 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 122.075 -0.39 . . . . 0.0 111.275 -177.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.459 HD11 ' CG2' ' A' ' 102' ' ' ILE . 9.2 tp -122.08 140.28 52.71 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.141 -174.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 36.2 p90 -143.16 157.83 44.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.776 0.322 . . . . 0.0 110.467 176.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 31.0 mtm105 -101.85 147.33 26.64 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.893 0.378 . . . . 0.0 110.917 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -128.51 160.8 31.19 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.968 0.889 . . . . 0.0 111.619 -177.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -48.75 148.97 1.91 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.06 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 43.5 mtp180 64.25 30.9 13.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.252 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 47.8 t 67.62 35.24 4.16 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.94 0.4 . . . . 0.0 111.586 165.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -101.89 151.26 22.31 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.633 HD13 ' CH2' ' B' 1345 ' ' TRP . 74.2 mt -114.1 126.19 71.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -138.06 150.37 46.84 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -148.51 169.46 29.09 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.043 -175.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -125.15 138.84 54.15 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.992 0.425 . . . . 0.0 110.663 -178.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 44.7 t90 -107.05 125.71 51.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.693 176.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.407 ' CD2' HG22 ' A' ' 31' ' ' VAL . 60.7 m-85 -111.68 144.4 41.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.827 0.346 . . . . 0.0 110.669 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -52.39 -38.03 57.94 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.553 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 -131.48 134.35 46.07 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.761 0.315 . . . . 0.0 110.494 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.8 m -61.87 -42.46 99.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.064 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -59.84 -43.39 94.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.371 0.605 . . . . 0.0 110.061 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -56.68 -44.22 81.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.509 0.671 . . . . 0.0 110.12 178.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 42.6 t -59.92 -40.27 88.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.675 178.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -59.57 -44.53 93.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.777 0.323 . . . . 0.0 110.674 -177.16 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -59.74 -49.5 77.5 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.011 0.434 . . . . 0.0 110.461 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.665 HG23 HD11 ' A' ' 54' ' ' ILE . 30.3 mm -58.3 -45.02 89.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.14 0.495 . . . . 0.0 110.038 -178.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 56.5 p -59.43 -43.51 93.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.733 -177.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.62 -43.9 94.13 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 110.653 -0.979 . . . . 0.0 110.653 -178.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.507 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.2 mt -59.12 -49.89 76.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.063 0.458 . . . . 0.0 110.601 -178.341 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 56.9 t -58.93 -42.81 87.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.129 -178.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -57.77 -43.25 85.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.535 -178.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -60.9 -44.97 97.46 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 111.016 -0.833 . . . . 0.0 111.016 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.449 HD22 ' CD2' ' A' ' 63' ' ' HIS . 61.7 mt -57.77 -42.87 84.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.966 0.413 . . . . 0.0 110.488 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 70.4 mt . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.686 -179.836 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B 1338 ' ' LEU . . . . . 0.441 HD12 ' CB ' ' A' ' 43' ' ' TRP . 17.6 mt . . . . . 0 CA--C 1.531 0.223 0 N-CA-C 109.97 -0.381 . . . . 0.0 109.97 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -79.17 139.86 15.24 Favored 'Trans proline' 0 N--CA 1.492 1.393 0 C-N-CA 121.2 1.267 . . . . 0.0 111.201 174.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -97.03 125.7 45.12 Favored Pre-proline 0 CA--C 1.535 0.377 0 CA-C-O 118.8 -0.619 . . . . 0.0 110.022 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -74.15 155.61 47.1 Favored 'Trans proline' 0 N--CA 1.496 1.636 0 C-N-CA 121.488 1.459 . . . . 0.0 111.774 173.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -53.63 154.68 15.37 Favored 'Trans proline' 0 N--CA 1.496 1.625 0 C-N-CA 121.341 1.361 . . . . 0.0 111.561 177.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B 1343 ' ' LEU . . . . . 0.541 ' H ' HD12 ' B' 1343 ' ' LEU . 6.2 mp -50.42 -29.63 10.63 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -176.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -55.52 -38.58 69.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.865 0.364 . . . . 0.0 111.138 -177.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B 1345 ' ' TRP . . . . . 0.633 ' CH2' HD13 ' A' ' 102' ' ' ILE . 8.9 t90 -60.97 -48.08 83.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.136 -177.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -61.29 -49.88 75.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.14 0.495 . . . . 0.0 110.592 -177.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -60.17 -46.21 90.45 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.006 -175.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -58.69 -46.15 87.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.717 -176.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.99 -49.32 77.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.881 -177.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 . . . . . 0 C--N 1.327 -0.396 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.312 -175.173 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.6 m . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.855 0.36 . . . . 0.0 110.737 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.3 mm -60.64 -47.3 93.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.203 -178.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 32.1 m -58.92 -43.67 91.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.531 -177.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -59.62 -45.35 92.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.488 -178.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 66.5 mtt -58.21 -44.35 88.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.117 0.484 . . . . 0.0 110.434 -178.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.9 m120 -60.37 -48.91 79.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.383 -178.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.628 ' HA ' HD12 ' A' ' 14' ' ' ILE . 9.4 tp -60.76 -32.89 72.18 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.21 -178.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.62 -49.92 73.3 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.638 0.256 . . . . 0.0 110.686 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.87 -41.95 88.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.021 0.439 . . . . 0.0 110.514 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.672 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 93.4 mt -54.27 -52.97 33.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.632 178.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -53.84 -20.72 6.23 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -58.29 -34.88 71.02 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 122.266 -0.271 . . . . 0.0 111.589 -178.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.728 HG21 ' CB ' ' A' ' 75' ' ' SER . 46.6 mm -112.97 -39.51 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 CA-C-O 120.757 0.313 . . . . 0.0 110.617 -177.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -117.18 77.2 9.29 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.178 -178.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -55.99 -21.09 32.59 Favored 'Trans proline' 0 N--CA 1.497 1.735 0 C-N-CA 121.491 1.461 . . . . 0.0 113.432 -175.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 37.2 p90 -89.11 7.05 37.1 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -174.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -80.61 122.67 27.37 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 174.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.0 ttmm -97.71 -40.4 8.59 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.846 -174.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -149.29 152.53 36.05 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.344 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 41.5 mt -93.27 137.18 23.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.875 177.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.1 t -90.21 -45.99 14.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.704 177.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.496 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -156.49 157.08 34.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.908 178.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.8 p -142.39 132.79 25.0 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.996 0.426 . . . . 0.0 111.12 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 14.9 t -107.83 126.35 52.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.663 175.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 88.1 p -54.81 -37.94 66.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.343 -171.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -150.31 125.91 10.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.116 0.484 . . . . 0.0 111.724 -178.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.449 HG22 ' CD1' ' A' ' 107' ' ' PHE . 95.6 t -145.24 143.67 21.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.774 -177.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -131.21 149.48 52.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.866 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -99.22 131.29 45.35 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.261 0.553 . . . . 0.0 111.475 -177.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -124.68 139.71 53.6 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.507 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 72.7 m -119.92 146.8 45.45 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 177.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -106.8 132.03 53.23 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 120.983 0.42 . . . . 0.0 110.381 175.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 30.3 t-20 -104.42 115.79 30.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.947 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.0 m -67.54 -33.01 74.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.899 -177.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.3 p -61.63 -38.57 88.17 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 121.023 -0.271 . . . . 0.0 110.916 -177.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -93.75 -21.42 19.33 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 69.03 42.5 1.26 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.268 0.556 . . . . 0.0 109.825 -177.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -152.27 165.1 35.95 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.144 -177.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.456 ' CB ' HD12 ' B' 1338 ' ' LEU . 85.8 m95 -93.88 141.42 28.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.357 177.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -125.03 126.48 45.47 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 176.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -72.86 141.05 47.95 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 177.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 63.3 p -92.19 177.38 6.17 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.254 -178.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -87.09 14.19 8.0 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 45.2 t -109.28 106.37 20.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 120.966 0.412 . . . . 0.0 110.366 179.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -129.91 111.9 13.01 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 173.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.71 176.49 39.01 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 120.192 -1.004 . . . . 0.0 112.176 -168.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.483 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.09 135.43 37.71 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 174.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -100.42 128.26 46.53 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 -176.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.483 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.0 m-85 -131.56 143.04 50.08 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.249 177.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.638 HD11 HG23 ' A' ' 116' ' ' ILE . 69.6 mt -101.54 127.78 54.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 172.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.672 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.8 m-30 -108.48 137.35 46.58 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.984 0.421 . . . . 0.0 111.298 -175.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 30.5 t60 -117.78 143.25 46.41 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.173 175.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 62.6 ttt180 -142.03 148.37 38.36 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.093 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -86.95 28.15 0.94 Allowed 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.95 164.76 36.52 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -64.01 129.47 93.94 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-O 118.491 -0.766 . . . . 0.0 110.012 -177.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.93 140.87 69.71 Favored 'Cis proline' 0 N--CA 1.497 1.71 0 CA-C-N 121.804 1.68 . . . . 0.0 111.693 -1.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -65.61 -44.72 85.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.007 -177.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -142.79 137.37 29.66 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.442 0.639 . . . . 0.0 110.924 -176.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.4 t -150.61 152.3 33.85 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.326 -177.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.432 HG13 HD11 ' A' ' 80' ' ' ILE . 46.1 mt -110.86 138.54 38.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -179.147 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -131.87 141.93 49.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.066 -176.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.1 mt -123.06 133.25 69.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.218 0.532 . . . . 0.0 109.872 172.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -100.77 99.56 10.11 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.553 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.2 t-20 -71.53 108.58 4.99 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 123.716 0.635 . . . . 0.0 111.023 -175.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -74.82 -38.37 62.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.405 -171.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 67.0 mt -72.9 -45.17 59.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.46 -175.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 49.5 m-20 -95.12 -3.08 48.67 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -175.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.9 p 51.34 42.39 29.07 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.507 0.67 . . . . 0.0 111.03 178.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 40.9 m -127.44 149.07 50.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.812 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.728 ' CB ' HG21 ' A' ' 17' ' ' ILE . 52.7 p -101.86 144.77 30.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.896 0.379 . . . . 0.0 111.292 -177.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -138.6 122.25 17.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.189 177.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.7 p -125.55 148.93 30.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.074 -178.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 48.3 tt0 -147.9 136.61 11.5 Favored Pre-proline 0 CA--C 1.537 0.48 0 CA-C-O 119.059 -0.496 . . . . 0.0 110.597 175.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -75.31 150.89 37.5 Favored 'Trans proline' 0 N--CA 1.497 1.733 0 C-N-CA 121.673 1.582 . . . . 0.0 112.435 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.432 HD11 HG13 ' A' ' 65' ' ' ILE . 65.2 mt -90.59 123.69 42.87 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-O 120.935 0.398 . . . . 0.0 110.382 178.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.0 p -99.15 160.88 13.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.003 176.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -98.23 6.03 61.37 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 120.972 -0.632 . . . . 0.0 113.683 -177.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 62.7 m -100.34 -0.96 37.33 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.035 0.917 . . . . 0.0 113.034 177.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.1 mt -69.23 139.92 54.5 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-N 118.105 0.412 . . . . 0.0 111.411 -177.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.7 tt0 -111.43 135.82 51.45 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.539 174.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 74.4 mt -112.99 156.91 22.22 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.149 0.499 . . . . 0.0 111.371 -175.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -142.09 140.0 32.4 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.7 t -104.83 109.1 20.92 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.982 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -106.94 103.69 48.59 Favored Pre-proline 0 C--N 1.329 -0.297 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 170.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.1 141.49 48.06 Favored 'Trans proline' 0 N--CA 1.497 1.685 0 CA-C-N 120.627 1.26 . . . . 0.0 111.833 -172.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -90.54 11.74 57.89 Favored 'Cis proline' 0 N--CA 1.498 1.773 0 CA-C-N 121.154 1.448 . . . . 0.0 113.699 -3.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -91.3 170.7 9.77 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.544 0.211 . . . . 0.0 110.806 -177.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 47.4 tp -120.8 135.96 55.02 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 173.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.473 HD11 ' CG2' ' A' ' 102' ' ' ILE . 9.3 tp -127.14 140.02 52.55 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -175.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -143.77 155.91 44.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.878 0.371 . . . . 0.0 110.602 175.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 27.5 mtm105 -101.9 146.62 27.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.723 -178.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -128.07 163.75 23.91 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.722 0.772 . . . . 0.0 111.385 -177.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -47.31 146.17 2.06 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.227 -177.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 25.1 mmt85 65.12 30.9 11.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.173 -0.922 . . . . 0.0 112.136 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.6 m 66.36 35.17 5.9 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.898 0.38 . . . . 0.0 111.616 166.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -99.35 150.06 22.52 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.473 ' CG2' HD11 ' A' ' 94' ' ' LEU . 77.8 mt -114.47 127.76 71.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 121.076 0.465 . . . . 0.0 109.774 -178.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 90.3 mtt180 -137.24 145.91 44.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.412 178.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.85 169.35 25.29 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -125.29 138.77 54.09 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.783 0.325 . . . . 0.0 110.909 -178.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 77.8 t90 -104.09 126.74 51.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.517 175.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.449 ' CD1' HG22 ' A' ' 31' ' ' VAL . 68.6 m-85 -115.6 141.37 48.16 Favored 'General case' 0 C--N 1.33 -0.276 0 O-C-N 123.244 0.34 . . . . 0.0 110.563 -179.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -50.68 -37.96 44.08 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.785 178.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -133.52 137.29 45.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.305 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.2 t -62.21 -42.36 99.22 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.127 -178.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -59.32 -44.29 92.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.425 0.631 . . . . 0.0 110.043 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -56.78 -44.05 81.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.088 178.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 51.8 t -58.93 -39.01 80.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.551 177.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -59.09 -46.19 88.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.8 0.333 . . . . 0.0 110.566 -177.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.9 mtm105 -61.4 -49.92 74.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.745 -177.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.638 HG23 HD11 ' A' ' 54' ' ' ILE . 28.1 mm -58.54 -43.88 88.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.033 0.444 . . . . 0.0 109.955 -178.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 57.3 p -59.81 -44.25 94.1 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.674 -177.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.54 -43.91 93.99 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 -178.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.496 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.5 mt -58.8 -48.67 80.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.142 0.496 . . . . 0.0 110.508 -178.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 54.7 t -59.0 -42.85 87.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.146 -178.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -57.36 -42.66 82.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.915 0.388 . . . . 0.0 110.566 -178.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.68 -43.54 99.12 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.243 -0.743 . . . . 0.0 111.243 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.7 mt -60.76 -42.2 96.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.801 0.334 . . . . 0.0 110.832 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 81.0 mt . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.139 -177.928 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B 1338 ' ' LEU . . . . . 0.456 HD12 ' CB ' ' A' ' 43' ' ' TRP . 14.6 mt . . . . . 0 CA--C 1.53 0.203 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -79.14 139.7 15.18 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 C-N-CA 121.177 1.252 . . . . 0.0 111.366 174.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -97.17 125.94 43.95 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-O 118.463 -0.78 . . . . 0.0 109.628 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo -78.1 161.58 29.4 Favored 'Trans proline' 0 N--CA 1.496 1.656 0 C-N-CA 121.187 1.258 . . . . 0.0 111.929 178.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -49.91 157.0 2.94 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 C-N-CA 121.345 1.363 . . . . 0.0 111.838 177.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 81.2 mt -49.98 -23.56 2.08 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -177.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -58.33 -36.34 73.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.702 0.286 . . . . 0.0 111.497 -176.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B 1345 ' ' TRP . . . . . 0.444 ' CH2' HD13 ' A' ' 102' ' ' ILE . 49.1 t90 -65.06 -48.4 73.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.685 -0.234 . . . . 0.0 111.061 -173.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -70.84 -40.13 72.56 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.881 -176.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -61.05 -46.27 91.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.858 0.361 . . . . 0.0 110.578 -179.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -59.83 -47.75 84.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.616 -176.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.07 -47.79 83.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.981 0.419 . . . . 0.0 110.773 -177.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.319 -175.307 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.5 m . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.876 0.37 . . . . 0.0 110.571 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.9 mm -60.34 -45.11 96.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.133 -178.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.3 m -59.21 -44.75 92.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.924 0.392 . . . . 0.0 110.561 -177.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -60.12 -45.64 92.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.482 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 66.2 mtt -58.13 -42.43 85.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.992 0.425 . . . . 0.0 110.457 -178.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -60.93 -50.52 73.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.251 -178.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.739 ' HA ' HD12 ' A' ' 14' ' ' ILE . 13.1 tp -59.84 -30.34 68.88 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.794 -0.363 . . . . 0.0 111.32 -179.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.3 -51.99 60.72 Favored 'General case' 0 C--N 1.332 -0.153 0 O-C-N 122.161 -0.337 . . . . 0.0 110.754 178.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.65 -40.83 80.17 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.027 0.441 . . . . 0.0 110.553 179.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.739 HD12 ' HA ' ' A' ' 11' ' ' LEU . 93.9 mt -54.12 -53.01 31.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.608 178.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -51.9 -25.19 7.52 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -178.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -59.26 -34.37 72.16 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -177.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.5 mm -106.53 -44.79 7.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.112 0.482 . . . . 0.0 109.938 -177.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -117.2 77.49 9.57 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.628 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -55.05 -20.66 24.3 Favored 'Trans proline' 0 N--CA 1.497 1.704 0 C-N-CA 121.491 1.461 . . . . 0.0 113.631 -174.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.3 p90 -89.03 2.06 54.61 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -174.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -78.59 130.23 35.69 Favored 'General case' 0 C--O 1.231 0.093 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 175.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -108.84 -39.25 5.39 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.025 -174.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.3 tt0 -131.63 146.03 51.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.995 0.426 . . . . 0.0 111.137 -175.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.467 HG13 HD13 ' A' ' 11' ' ' LEU . 58.7 mt -100.54 132.07 46.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.681 172.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.1 t -91.59 -47.12 14.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.098 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.516 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -157.22 157.51 34.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.953 178.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 64.2 p -143.64 132.24 22.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.119 0.485 . . . . 0.0 111.234 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.6 t -107.05 126.59 52.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.551 176.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.6 m -54.54 -38.87 67.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.313 -172.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -149.81 126.6 11.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.119 0.485 . . . . 0.0 111.68 -178.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.424 HG21 ' HB3' ' A' ' 52' ' ' PHE . 93.8 t -145.22 140.53 22.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.09 -0.959 . . . . 0.0 109.531 -177.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.56 149.84 51.15 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.684 0.278 . . . . 0.0 111.203 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.527 ' CD2' HG21 ' A' ' 46' ' ' THR . 14.2 t80 -98.5 131.03 45.07 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.365 0.602 . . . . 0.0 111.798 -176.251 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -127.5 140.41 52.16 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.199 177.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.3 m -121.66 145.49 47.95 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -109.15 131.0 55.48 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.913 0.387 . . . . 0.0 110.344 177.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -101.94 115.21 30.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.835 176.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 85.4 p -68.71 -31.35 70.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.998 -0.547 . . . . 0.0 112.015 -177.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.1 m -62.44 -37.81 87.32 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.652 0.263 . . . . 0.0 111.076 -178.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -95.59 -21.45 18.23 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -178.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 54.8 t30 69.4 46.08 0.79 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.524 0.678 . . . . 0.0 109.425 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 74.5 tt0 -155.06 151.46 28.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.058 -177.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.425 ' CB ' HD12 ' B' 1338 ' ' LEU . 85.6 m95 -88.18 141.85 28.23 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.307 176.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -121.93 129.01 52.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.881 176.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -74.53 136.92 42.15 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 178.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.527 HG21 ' CD2' ' A' ' 33' ' ' PHE . 71.5 p -92.3 169.88 10.24 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.188 -178.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.4 p-10 -83.12 11.13 6.78 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.8 t -101.62 106.47 19.7 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-O 120.934 0.397 . . . . 0.0 110.287 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -131.51 111.37 11.71 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 175.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.63 176.57 38.94 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.015 -1.088 . . . . 0.0 112.307 -168.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.485 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -80.6 134.9 35.97 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 174.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.424 ' HB3' HG21 ' A' ' 31' ' ' VAL . 5.4 t80 -99.21 128.37 45.33 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 -176.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.485 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.2 m-85 -132.52 143.05 49.48 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.341 177.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.649 HD11 HG23 ' A' ' 116' ' ' ILE . 68.9 mt -101.59 127.71 54.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 172.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.66 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 15.3 m-30 -108.44 138.29 44.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.845 0.355 . . . . 0.0 111.608 -176.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 64.1 t60 -114.66 143.37 45.14 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.283 174.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 29.3 ttp180 -141.46 152.35 44.15 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.481 177.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -86.95 28.19 0.93 Allowed 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.844 -0.617 . . . . 0.0 112.14 -178.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -155.45 152.15 28.64 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -63.98 133.51 95.61 Favored Pre-proline 0 CA--C 1.541 0.598 0 CA-C-O 118.456 -0.783 . . . . 0.0 110.323 -176.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -68.29 140.85 57.98 Favored 'Cis proline' 0 N--CA 1.498 1.746 0 CA-C-N 121.672 1.633 . . . . 0.0 111.409 -0.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -66.61 -38.78 87.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.253 -176.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -141.44 141.11 33.72 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.683 0.754 . . . . 0.0 111.122 -176.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.6 t -149.8 151.31 33.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.912 -178.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 50.4 mt -109.82 140.46 28.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.456 ' HD1' HG22 ' A' ' 77' ' ' VAL . 64.9 t80 -131.79 142.11 49.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.578 -177.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 58.9 mt -123.49 128.62 74.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.186 0.517 . . . . 0.0 109.894 172.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -94.07 99.54 11.82 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.171 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -75.45 106.85 7.2 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.65 0.594 . . . . 0.0 111.045 -174.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.413 HH21 ' HB2' ' A' ' 51' ' ' ALA . 98.6 mtt180 -72.45 -43.49 63.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.565 -171.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 67.3 mt -70.8 -45.17 65.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.731 -174.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 37.2 m-20 -95.09 -3.29 48.38 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -175.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.3 p 50.35 42.29 25.76 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.511 0.672 . . . . 0.0 111.257 177.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.5 m -127.16 145.93 50.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.232 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 97.5 p -88.24 132.64 34.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.248 -178.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -123.07 122.26 38.05 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 174.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.456 HG22 ' HD1' ' A' ' 66' ' ' PHE . 26.3 t -125.42 148.0 30.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 120.764 0.316 . . . . 0.0 110.946 -175.042 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -148.73 126.48 5.73 Favored Pre-proline 0 CA--C 1.539 0.552 0 CA-C-O 118.678 -0.677 . . . . 0.0 110.495 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -75.49 151.0 36.87 Favored 'Trans proline' 0 N--CA 1.499 1.836 0 C-N-CA 121.408 1.405 . . . . 0.0 112.05 177.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 70.3 mt -91.44 112.29 25.18 Favored 'Isoleucine or valine' 0 C--O 1.231 0.125 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.472 179.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 66.0 p -98.94 153.34 18.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.842 175.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -96.59 32.5 6.47 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.355 -178.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.0 m -111.05 -19.13 12.86 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 173.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.9 mt -68.81 145.69 53.53 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.914 0.388 . . . . 0.0 111.452 -175.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 54.8 tt0 -111.76 136.12 51.46 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.819 175.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.439 HD12 ' ND2' ' A' ' 121' ' ' ASN . 64.2 mt -110.97 158.64 18.55 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.709 -177.219 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -149.52 142.95 25.3 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.1 t -100.38 109.18 21.34 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.476 179.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 23.7 mm-40 -106.61 103.67 47.52 Favored Pre-proline 0 C--N 1.329 -0.296 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 173.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -67.5 141.15 54.64 Favored 'Trans proline' 0 N--CA 1.497 1.724 0 CA-C-N 120.512 1.219 . . . . 0.0 111.919 -171.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -90.6 11.14 59.37 Favored 'Cis proline' 0 N--CA 1.499 1.818 0 CA-C-N 121.173 1.455 . . . . 0.0 113.667 -5.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -92.3 170.33 9.88 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.516 0.326 . . . . 0.0 110.67 -176.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 56.2 tp -115.59 134.48 55.02 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 173.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 12.0 tp -127.58 140.23 52.25 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 -173.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -148.17 155.52 41.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.849 0.357 . . . . 0.0 110.477 175.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.2 mtm105 -104.71 147.97 27.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.947 -176.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -128.67 167.34 17.36 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.944 0.878 . . . . 0.0 111.339 -178.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -47.77 148.48 1.55 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.195 -0.912 . . . . 0.0 112.188 -177.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 62.82 30.96 16.65 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.134 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.2 p 65.34 35.33 7.61 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.758 0.313 . . . . 0.0 111.638 166.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 68.5 mtp180 -98.0 147.21 24.73 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 76.9 mt -111.65 127.05 69.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 -177.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -134.26 147.96 50.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.451 -179.117 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.39 166.43 26.81 Favored Glycine 0 CA--C 1.524 0.652 0 C-N-CA 120.901 -0.666 . . . . 0.0 111.621 -178.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -125.27 140.78 52.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.24 -0.48 . . . . 0.0 110.213 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 83.9 t90 -107.42 128.98 54.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.652 175.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -115.46 144.24 44.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.806 0.336 . . . . 0.0 110.76 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -52.1 -35.92 49.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.568 177.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -135.44 135.69 40.75 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.814 0.34 . . . . 0.0 110.487 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.7 t -62.58 -42.32 99.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.188 -177.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -59.44 -43.88 93.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.412 0.625 . . . . 0.0 110.099 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -56.42 -45.55 80.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.077 179.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 41.3 t -60.47 -38.59 84.71 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.858 178.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -59.14 -45.57 90.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.829 0.347 . . . . 0.0 110.488 -177.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 -60.58 -48.52 81.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.574 -178.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.649 HG23 HD11 ' A' ' 54' ' ' ILE . 28.5 mm -58.24 -44.94 89.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.044 0.45 . . . . 0.0 109.982 -178.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 57.8 p -59.35 -44.01 92.73 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.692 -177.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.62 -43.96 94.11 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.516 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.7 mt -58.74 -48.6 80.62 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.136 0.493 . . . . 0.0 110.502 -178.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 48.9 t -58.73 -44.12 89.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.141 -178.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.439 ' ND2' HD12 ' A' ' 86' ' ' LEU . 31.3 m120 -58.51 -41.9 86.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.828 -178.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.58 -42.94 99.64 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 111.411 -0.676 . . . . 0.0 111.411 -178.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 47.5 mt -63.29 -43.0 99.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.801 0.334 . . . . 0.0 111.172 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 25.4 mt . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.591 -176.884 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B 1338 ' ' LEU . . . . . 0.425 HD12 ' CB ' ' A' ' 43' ' ' TRP . 26.6 mt . . . . . 0 CA--C 1.532 0.256 0 CA-C-O 118.425 -0.797 . . . . 0.0 109.736 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -79.14 139.61 15.12 Favored 'Trans proline' 0 N--CA 1.494 1.532 0 CA-C-N 120.401 1.179 . . . . 0.0 111.16 174.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 26.3 mtmt -97.26 125.97 43.63 Favored Pre-proline 0 CA--C 1.535 0.384 0 CA-C-O 118.462 -0.78 . . . . 0.0 110.35 178.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -63.64 162.33 28.48 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 CA-C-N 120.697 1.284 . . . . 0.0 111.515 176.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -49.82 156.68 3.09 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 121.316 1.344 . . . . 0.0 111.739 178.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 82.0 mt -50.04 -28.81 7.6 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -176.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 64.0 t80 -55.69 -37.56 68.51 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.814 0.34 . . . . 0.0 111.205 -177.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 52.9 t90 -60.96 -48.13 83.26 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.425 -176.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -63.64 -48.89 75.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.035 0.445 . . . . 0.0 110.618 -178.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.29 -42.42 91.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.017 -176.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -59.37 -49.39 77.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.88 0.371 . . . . 0.0 110.592 -176.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.21 -49.44 77.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.771 -177.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.331 -175.742 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.8 m . . . . . 0 CA--C 1.526 0.044 0 CA-C-O 120.932 0.396 . . . . 0.0 110.809 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.3 mm -60.67 -47.72 91.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.13 -178.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.7 m -58.45 -43.43 88.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.466 -177.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -60.02 -45.76 91.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.644 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 89.7 mtp -58.21 -43.06 87.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.04 0.448 . . . . 0.0 110.448 -178.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -60.69 -50.16 74.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.298 -178.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.729 ' HA ' HD12 ' A' ' 14' ' ' ILE . 14.1 tp -60.66 -30.77 70.1 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.276 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.15 -50.7 69.38 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 122.276 -0.265 . . . . 0.0 110.601 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.97 -41.67 83.43 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.001 0.429 . . . . 0.0 110.424 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.729 HD12 ' HA ' ' A' ' 11' ' ' LEU . 94.4 mt -54.23 -52.94 33.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.594 178.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -53.95 -24.38 16.3 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -59.25 -33.22 70.76 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.0 mm -107.9 -42.09 5.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.765 0.317 . . . . 0.0 110.298 -177.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 35.9 t0 -115.11 85.47 12.42 Favored Pre-proline 0 CA--C 1.533 0.323 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.709 -175.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -53.75 -24.4 30.28 Favored 'Trans proline' 0 N--CA 1.497 1.709 0 C-N-CA 121.421 1.414 . . . . 0.0 113.319 -177.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.6 p90 -95.5 19.56 10.81 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 -175.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -101.94 118.21 36.43 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 172.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.45 ' O ' HD21 ' A' ' 11' ' ' LEU . 70.3 mmtt -112.98 -33.51 6.03 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -173.386 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -127.91 142.47 51.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.842 0.354 . . . . 0.0 110.684 -178.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.478 HG13 HD13 ' A' ' 11' ' ' LEU . 57.8 mt -99.43 129.78 49.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.827 173.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.9 t -90.57 -47.23 14.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.268 -0.423 . . . . 0.0 109.943 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.489 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.9 t0 -154.37 154.42 33.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.991 178.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 58.7 p -142.29 131.95 24.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.045 0.45 . . . . 0.0 111.009 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 38.5 t -107.58 126.61 52.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.682 177.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 86.7 p -54.59 -38.05 66.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.232 -172.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 61.0 t-80 -151.15 126.06 9.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.256 0.55 . . . . 0.0 111.523 -179.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.44 HG22 ' CD2' ' A' ' 107' ' ' PHE . 99.6 t -144.86 142.18 23.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.44 -178.018 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -130.53 149.76 52.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.09 -178.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.575 ' CD2' HG21 ' A' ' 46' ' ' THR . 13.7 t80 -97.12 131.02 44.3 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.275 0.559 . . . . 0.0 111.588 -177.401 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.422 ' CD1' HD11 ' B' 1338 ' ' LEU . 34.5 m-85 -124.42 141.18 52.28 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.585 178.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 92.2 m -122.34 145.08 48.59 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 177.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -108.03 130.45 55.07 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 120.893 0.378 . . . . 0.0 110.313 177.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -101.29 114.86 29.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.784 176.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 27.1 m -67.49 -32.94 74.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.842 -177.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.0 m -61.47 -38.41 87.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.635 0.255 . . . . 0.0 111.006 -177.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -94.58 -21.5 18.8 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -178.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 25.8 t30 68.81 45.53 0.99 Allowed 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.426 0.631 . . . . 0.0 109.438 -177.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 78.2 tt0 -154.05 150.95 28.76 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.083 -176.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.416 ' CB ' HD12 ' B' 1338 ' ' LEU . 89.4 m95 -86.51 142.02 28.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.255 176.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -125.04 134.09 52.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.34 -0.391 . . . . 0.0 109.99 176.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -75.53 140.95 43.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.287 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.575 HG21 ' CD2' ' A' ' 33' ' ' PHE . 62.6 p -92.39 172.36 8.44 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.066 178.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -83.86 12.61 5.84 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.9 t -108.41 106.49 20.79 Favored 'Isoleucine or valine' 0 C--O 1.231 0.123 0 CA-C-O 121.067 0.46 . . . . 0.0 110.43 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -129.96 112.63 13.69 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 173.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.61 176.49 38.93 Favored Glycine 0 CA--C 1.52 0.391 0 C-N-CA 120.192 -1.004 . . . . 0.0 112.354 -168.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.5 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.75 134.79 37.02 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 175.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -100.04 126.9 46.31 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.146 -175.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.5 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 7.3 m-85 -131.52 142.16 49.89 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.767 0.318 . . . . 0.0 110.537 177.059 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.621 HD11 HG23 ' A' ' 116' ' ' ILE . 67.7 mt -101.68 126.72 55.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 172.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.685 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 14.0 m-30 -108.46 137.69 46.01 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.826 0.346 . . . . 0.0 111.343 -176.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 58.1 t60 -114.11 143.29 45.03 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.368 175.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.8 tpt180 -142.09 147.53 36.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.427 175.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.8 m120 -86.79 28.17 0.92 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.25 171.32 20.41 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -63.98 124.75 86.2 Favored Pre-proline 0 CA--C 1.539 0.535 0 CA-C-O 118.439 -0.791 . . . . 0.0 110.021 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -78.73 140.93 61.65 Favored 'Cis proline' 0 N--CA 1.498 1.746 0 CA-C-N 121.994 1.748 . . . . 0.0 111.906 -0.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -63.83 -46.53 84.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.096 -177.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.465 ' HB3' HD12 ' A' ' 80' ' ' ILE . 77.0 m80 -143.15 138.66 29.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.341 0.591 . . . . 0.0 110.992 -176.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.6 t -150.18 152.06 34.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.37 -178.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.426 HG13 HD11 ' A' ' 80' ' ' ILE . 50.8 mt -114.48 137.14 48.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 -178.148 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -131.91 142.19 49.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.537 -176.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 62.2 mt -120.4 129.93 75.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.2 0.524 . . . . 0.0 109.706 172.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -96.13 99.55 11.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.981 -1.009 . . . . 0.0 109.322 179.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.3 t-20 -71.79 106.28 4.09 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 123.669 0.605 . . . . 0.0 111.062 -174.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -74.01 -40.07 63.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.252 -171.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 72.9 mt -72.05 -45.19 61.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.648 -174.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 60.9 m-20 -95.11 -3.32 48.25 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 -175.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.437 ' O ' HG22 ' A' ' 73' ' ' THR . 13.3 m 55.6 43.18 28.66 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-O 121.493 0.663 . . . . 0.0 110.561 177.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.6 m -127.52 148.9 50.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.56 -177.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.9 p -99.2 135.36 40.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.322 -179.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -131.91 122.23 25.3 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.673 0.273 . . . . 0.0 110.266 175.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.7 p -125.54 149.88 30.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.094 -177.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 26.4 tp10 -147.36 133.95 9.88 Favored Pre-proline 0 CA--C 1.538 0.509 0 CA-C-O 118.861 -0.59 . . . . 0.0 110.302 174.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.42 150.94 37.1 Favored 'Trans proline' 0 N--CA 1.498 1.765 0 C-N-CA 121.54 1.494 . . . . 0.0 112.301 179.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.465 HD12 ' HB3' ' A' ' 63' ' ' HIS . 63.7 mt -89.47 139.5 17.36 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.19 177.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.1 p -132.09 156.88 45.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.867 177.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -98.16 37.71 3.37 Favored Glycine 0 CA--C 1.524 0.6 0 C-N-CA 121.0 -0.619 . . . . 0.0 111.832 -178.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 51.6 p -111.07 -23.19 11.06 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 174.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.8 mt -69.09 145.82 53.1 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.977 0.418 . . . . 0.0 111.502 -175.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 57.0 tt0 -113.66 135.92 53.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.556 175.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 68.9 mt -111.12 160.0 17.31 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.99 0.424 . . . . 0.0 110.978 -175.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -149.52 140.76 23.12 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.219 -0.659 . . . . 0.0 109.219 178.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.5 t -99.12 109.19 21.93 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.871 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -106.8 103.81 48.7 Favored Pre-proline 0 C--N 1.329 -0.307 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 172.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -71.67 139.87 34.77 Favored 'Trans proline' 0 N--CA 1.497 1.708 0 CA-C-N 120.501 1.215 . . . . 0.0 112.047 -171.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -88.99 9.49 64.49 Favored 'Cis proline' 0 N--CA 1.501 1.926 0 CA-C-N 121.22 1.471 . . . . 0.0 113.684 -4.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -84.61 170.41 13.4 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.775 0.321 . . . . 0.0 110.986 -177.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.1 tp -118.84 133.34 55.9 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 170.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.421 HD11 ' CG2' ' A' ' 102' ' ' ILE . 10.9 tp -126.01 141.01 52.14 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.538 0.209 . . . . 0.0 110.499 -174.409 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 15.3 p90 -147.4 156.37 42.82 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.799 0.333 . . . . 0.0 110.382 176.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.7 mtm105 -101.93 144.24 30.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.97 0.414 . . . . 0.0 110.734 -178.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -124.95 162.84 23.59 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.738 0.78 . . . . 0.0 111.446 -176.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -47.75 146.21 2.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.164 -177.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 65.36 30.92 10.81 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.067 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 43.1 t 66.17 35.19 6.24 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.863 0.363 . . . . 0.0 111.7 164.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.9 mtt-85 -102.93 152.76 20.94 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.469 HD13 ' CH2' ' B' 1345 ' ' TRP . 81.4 mt -111.99 127.75 68.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-O 121.075 0.464 . . . . 0.0 109.813 -176.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 80.4 mtt180 -130.25 147.13 51.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.463 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -142.61 166.29 26.56 Favored Glycine 0 CA--C 1.523 0.537 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 -178.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -126.05 140.84 52.27 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.742 0.306 . . . . 0.0 110.749 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 13.5 t90 -108.5 128.27 54.65 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.608 175.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.44 ' CD2' HG22 ' A' ' 31' ' ' VAL . 58.3 m-85 -117.54 144.22 45.32 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.769 0.319 . . . . 0.0 110.631 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -52.4 -36.79 54.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.582 178.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 39.1 t-20 -134.01 135.05 43.15 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.757 0.313 . . . . 0.0 110.511 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.3 p -61.92 -41.39 97.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.172 -177.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -60.69 -43.18 98.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.421 0.629 . . . . 0.0 110.159 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -56.53 -45.31 81.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.579 0.704 . . . . 0.0 109.99 178.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 42.1 t -60.01 -39.27 85.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.705 178.02 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -58.72 -44.91 90.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.907 0.384 . . . . 0.0 110.545 -177.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -60.25 -48.77 80.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.593 -177.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.621 HG23 HD11 ' A' ' 54' ' ' ILE . 31.0 mm -58.51 -45.45 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.064 0.459 . . . . 0.0 109.979 -178.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.5 p -59.7 -43.78 93.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.733 -177.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.72 -43.79 94.36 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 -178.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.489 HD13 ' HB2' ' A' ' 26' ' ' ASP . 10.3 mt -59.15 -48.92 79.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.054 0.454 . . . . 0.0 110.616 -178.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 58.7 t -59.21 -43.13 88.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.056 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 27.3 m120 -57.54 -42.55 83.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.6 -178.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.79 -45.44 96.21 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 -179.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 27.4 mt -58.56 -42.21 87.4 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.876 0.37 . . . . 0.0 110.594 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 80.6 mt . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.638 179.27 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B 1338 ' ' LEU . . . . . 0.422 HD11 ' CD1' ' A' ' 34' ' ' TYR . 12.0 mt . . . . . 0 CA--C 1.531 0.231 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.1 139.74 15.28 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 C-N-CA 121.09 1.193 . . . . 0.0 111.257 175.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 12.1 mmmt -97.13 125.74 44.74 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-O 118.783 -0.627 . . . . 0.0 110.011 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -74.2 155.22 46.91 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 121.396 1.397 . . . . 0.0 111.565 172.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -50.66 157.02 3.83 Favored 'Trans proline' 0 N--CA 1.495 1.569 0 C-N-CA 121.236 1.291 . . . . 0.0 111.721 178.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 82.4 mt -50.04 -26.93 4.84 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 57.1 t80 -55.15 -38.13 67.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.892 0.377 . . . . 0.0 111.086 -177.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B 1345 ' ' TRP . . . . . 0.469 ' CH2' HD13 ' A' ' 102' ' ' ILE . 46.3 t90 -61.12 -48.04 83.49 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.298 -177.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -60.07 -46.87 88.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.97 0.414 . . . . 0.0 110.421 -177.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -60.41 -43.75 96.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.955 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -59.14 -45.59 90.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.773 -177.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -62.59 -52.91 61.54 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.858 -176.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 19.0 pt20 . . . . . 0 C--N 1.327 -0.375 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.482 -176.082 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.8 t . . . . . 0 C--O 1.23 0.029 0 CA-C-O 121.043 0.449 . . . . 0.0 110.507 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.4 mm -59.69 -44.53 93.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.18 -178.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.3 m -59.48 -44.97 92.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.449 -177.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -59.55 -45.27 92.31 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.52 -178.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 88.5 mtp -58.22 -43.68 87.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.02 0.438 . . . . 0.0 110.421 -178.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -60.32 -49.22 78.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.269 -178.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.608 ' HA ' HD12 ' A' ' 14' ' ' ILE . 10.7 tp -59.16 -33.85 71.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.972 -179.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.37 -50.54 69.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.546 0.212 . . . . 0.0 110.875 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.01 -42.13 84.57 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.976 0.417 . . . . 0.0 110.441 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.608 HD12 ' HA ' ' A' ' 11' ' ' LEU . 94.8 mt -54.22 -52.92 33.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.7 178.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -51.54 -25.13 6.15 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -178.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.5 tptp -57.84 -35.52 71.02 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.603 0.24 . . . . 0.0 111.469 -178.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.3 mm -103.92 -47.88 10.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.119 0.485 . . . . 0.0 109.792 -178.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -117.57 79.18 12.16 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.043 -176.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -54.72 -20.59 22.31 Favored 'Trans proline' 0 N--CA 1.498 1.746 0 C-N-CA 121.545 1.497 . . . . 0.0 113.695 -175.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 19.5 p90 -90.41 5.45 47.45 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -174.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -80.72 125.12 29.65 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 173.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.581 ' O ' HD21 ' A' ' 11' ' ' LEU . 79.7 tttt -104.59 -39.51 6.35 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.814 -0.354 . . . . 0.0 111.124 -172.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -134.41 146.33 49.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.956 0.408 . . . . 0.0 111.27 -175.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.444 HD11 HD12 ' A' ' 14' ' ' ILE . 21.1 mt -100.87 133.65 43.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 172.024 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.7 t -92.39 -47.19 14.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.936 179.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.516 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -152.07 154.18 35.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.068 178.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.4 p -141.82 132.02 24.87 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.01 0.433 . . . . 0.0 110.748 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.7 t -107.4 128.98 54.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.737 176.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 87.3 p -54.58 -37.87 66.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.302 -172.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -152.74 127.34 9.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.231 0.539 . . . . 0.0 111.702 -178.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.402 HG21 ' HB3' ' A' ' 52' ' ' PHE . 97.5 t -145.27 141.82 22.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 114.97 -1.014 . . . . 0.0 109.521 -177.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.92 149.9 51.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.041 -178.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.514 ' HD1' HG21 ' A' ' 46' ' ' THR . 27.1 t80 -100.72 131.64 46.51 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.278 0.561 . . . . 0.0 111.597 -177.005 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -126.5 144.73 50.77 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.826 179.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 84.2 m -122.71 147.94 45.89 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 177.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -108.84 132.0 54.44 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.983 0.421 . . . . 0.0 110.379 176.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.9 t-20 -104.1 114.76 29.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.779 177.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.9 m -67.7 -32.71 73.54 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.969 -176.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.0 t -60.37 -39.71 88.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.757 0.313 . . . . 0.0 110.904 -177.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -94.09 -21.41 19.14 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 69.37 43.97 0.99 Allowed 'General case' 0 C--O 1.232 0.139 0 CA-C-O 121.419 0.628 . . . . 0.0 109.703 -177.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -150.02 163.46 38.08 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.165 -177.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -96.43 139.77 32.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.25 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -123.69 130.28 52.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.083 176.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -75.27 142.48 43.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.0 178.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.514 HG21 ' HD1' ' A' ' 33' ' ' PHE . 72.9 p -92.33 177.21 6.21 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.719 -0.393 . . . . 0.0 110.07 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -86.93 13.6 8.79 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.4 t -109.48 106.39 20.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 120.928 0.394 . . . . 0.0 110.619 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -129.95 111.55 12.65 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 173.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.64 176.51 38.95 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 120.261 -0.971 . . . . 0.0 112.256 -168.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.473 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.53 136.72 37.63 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 175.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.402 ' HB3' HG21 ' A' ' 31' ' ' VAL . 4.3 t80 -101.64 126.16 48.43 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.27 -175.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.473 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 5.8 m-85 -129.88 142.25 50.69 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.817 0.341 . . . . 0.0 110.402 177.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.655 HD11 HG23 ' A' ' 116' ' ' ILE . 67.5 mt -101.61 127.02 55.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 172.188 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.593 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.1 m-30 -108.55 139.66 43.01 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.929 0.395 . . . . 0.0 111.516 -176.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -113.13 143.34 44.52 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.014 174.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 30.0 ttp180 -141.13 152.86 45.06 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.59 178.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -86.89 28.11 0.93 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.164 -178.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -155.3 152.35 29.1 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -63.98 133.78 95.71 Favored Pre-proline 0 CA--C 1.541 0.598 0 CA-C-O 118.49 -0.767 . . . . 0.0 110.252 -176.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -68.35 140.91 58.55 Favored 'Cis proline' 0 N--CA 1.499 1.797 0 CA-C-N 121.702 1.644 . . . . 0.0 111.437 -1.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -63.64 -38.72 92.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.189 -177.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -141.06 141.85 34.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.611 0.719 . . . . 0.0 111.086 -176.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.2 t -149.54 152.16 35.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.922 -178.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.465 HG13 HD11 ' A' ' 80' ' ' ILE . 54.0 mt -113.03 138.66 41.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 -177.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -131.79 142.09 49.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.146 -177.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.1 mt -121.11 130.55 74.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-O 121.275 0.559 . . . . 0.0 109.815 172.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -96.44 99.58 11.23 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.269 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.7 t-20 -72.16 107.12 4.66 Favored 'General case' 0 C--N 1.332 -0.176 0 O-C-N 123.58 0.55 . . . . 0.0 111.192 -174.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.6 mtm105 -74.51 -39.8 62.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.387 -171.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 56.7 mt -74.2 -45.17 50.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.475 -175.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 39.4 t-20 -95.05 -3.23 48.63 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -175.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 63.3 p 51.52 42.54 29.53 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.479 0.656 . . . . 0.0 110.959 178.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.6 m -124.37 148.92 47.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.201 -179.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 11.2 p -98.97 134.7 41.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.281 -178.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -131.39 122.15 25.83 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.33 175.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.5 p -125.58 149.76 30.49 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.008 -178.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -149.04 132.13 8.18 Favored Pre-proline 0 CA--C 1.538 0.511 0 CA-C-O 118.834 -0.603 . . . . 0.0 110.493 175.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.45 150.92 36.96 Favored 'Trans proline' 0 N--CA 1.499 1.816 0 C-N-CA 121.552 1.501 . . . . 0.0 112.276 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.465 HD11 HG13 ' A' ' 65' ' ' ILE . 66.1 mt -90.81 123.39 42.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.143 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.393 178.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 80.6 p -98.79 163.27 12.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.993 176.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -97.82 15.88 61.13 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 120.861 -0.685 . . . . 0.0 113.265 -178.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 40.7 p -111.0 2.1 17.82 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 117.746 0.773 . . . . 0.0 112.956 176.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.3 mt -69.49 141.07 54.01 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 118.077 0.399 . . . . 0.0 111.192 -177.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -113.99 135.8 53.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.739 175.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 67.2 mt -119.38 158.34 26.35 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.986 0.422 . . . . 0.0 111.121 -175.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -149.68 141.53 23.73 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 176.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.0 t -105.69 109.17 21.04 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.196 -178.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -106.77 103.66 47.98 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 118.306 -0.854 . . . . 0.0 108.757 170.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.73 143.75 62.95 Favored 'Trans proline' 0 N--CA 1.499 1.81 0 CA-C-N 120.6 1.25 . . . . 0.0 111.955 -171.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -90.72 14.46 50.44 Favored 'Cis proline' 0 N--CA 1.501 1.916 0 CA-C-N 121.016 1.398 . . . . 0.0 113.518 -3.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -94.55 161.87 14.03 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 122.36 0.264 . . . . 0.0 110.411 -178.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 46.9 tp -114.93 132.89 56.4 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 172.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.479 HD11 ' CG2' ' A' ' 102' ' ' ILE . 8.6 tp -122.73 139.42 53.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.282 -173.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 48.7 p90 -142.93 154.62 44.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.826 0.346 . . . . 0.0 110.488 175.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.2 mtm180 -101.78 145.76 28.71 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.7 -178.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -127.68 164.77 21.35 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.659 0.743 . . . . 0.0 111.534 -176.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -47.2 145.62 2.2 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.171 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 12.4 tpt180 65.28 30.91 10.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.322 -0.854 . . . . 0.0 112.019 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.0 t 64.93 35.27 8.41 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.896 0.379 . . . . 0.0 111.527 166.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 50.6 mtm180 -98.25 150.63 21.32 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 179.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.597 HD13 ' CH2' ' B' 1345 ' ' TRP . 74.2 mt -114.66 127.53 72.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 -178.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -140.14 150.39 44.19 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.612 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.7 169.32 26.08 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 120.965 -0.636 . . . . 0.0 111.634 -175.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -125.22 137.3 54.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.389 -0.405 . . . . 0.0 110.4 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 42.7 t90 -107.18 127.53 53.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.6 176.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -114.54 146.15 41.09 Favored 'General case' 0 C--N 1.329 -0.294 0 O-C-N 123.223 0.327 . . . . 0.0 110.509 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -51.57 -36.35 44.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.627 177.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -134.08 134.85 42.79 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.416 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.7 t -61.2 -41.81 97.48 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.988 -177.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -59.88 -43.02 94.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.359 0.599 . . . . 0.0 110.176 179.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -56.98 -44.54 82.76 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.937 178.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 43.3 t -59.98 -38.71 83.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.698 177.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -59.1 -46.05 89.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.876 0.369 . . . . 0.0 110.502 -177.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 60.6 ttm-85 -59.79 -48.71 80.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.053 0.454 . . . . 0.0 110.579 -178.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.655 HG23 HD11 ' A' ' 54' ' ' ILE . 30.1 mm -58.33 -44.56 88.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.052 -179.002 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 53.3 p -59.4 -44.2 92.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.649 -177.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.78 -44.59 94.14 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 -178.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.516 HD13 ' HB2' ' A' ' 26' ' ' ASP . 10.4 mt -58.73 -48.34 81.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.114 0.483 . . . . 0.0 110.553 -178.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 50.6 t -58.9 -43.41 88.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.078 -178.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -57.4 -42.43 82.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.636 -178.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.33 -45.3 96.73 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.954 -0.858 . . . . 0.0 110.954 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.6 mt -57.82 -42.69 84.79 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.93 0.395 . . . . 0.0 110.524 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 86.9 mt . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.636 179.869 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 16.8 mt . . . . . 0 C--O 1.232 0.168 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -79.03 139.86 15.47 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 C-N-CA 121.227 1.285 . . . . 0.0 110.841 173.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -95.66 125.72 48.13 Favored Pre-proline 0 CA--C 1.534 0.354 0 CA-C-O 118.803 -0.618 . . . . 0.0 109.667 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -77.95 154.03 29.43 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 121.446 1.431 . . . . 0.0 111.643 173.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -58.47 154.2 43.27 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 121.313 1.342 . . . . 0.0 111.404 177.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B 1343 ' ' LEU . . . . . 0.532 ' H ' HD12 ' B' 1343 ' ' LEU . 6.2 mp -50.66 -30.5 13.73 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -176.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -55.88 -38.04 69.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.82 0.343 . . . . 0.0 111.188 -177.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B 1345 ' ' TRP . . . . . 0.597 ' CH2' HD13 ' A' ' 102' ' ' ILE . 7.6 t90 -61.92 -48.06 82.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.151 -177.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -60.4 -47.06 87.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.113 0.483 . . . . 0.0 110.519 -177.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -59.93 -45.38 92.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.794 -177.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -57.81 -45.15 86.53 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.539 -177.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.21 -48.26 82.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.577 -178.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.951 -177.223 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 24.8 m . . . . . 0 CA--C 1.526 0.038 0 CA-C-O 120.919 0.39 . . . . 0.0 110.759 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.7 mm -60.66 -46.44 95.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.287 -178.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.5 m -59.12 -43.93 91.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.519 -177.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -59.64 -45.89 90.64 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.607 -178.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 66.0 mtt -58.26 -43.68 88.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.027 0.442 . . . . 0.0 110.347 -178.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -60.34 -48.56 81.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.35 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.642 ' HA ' HD12 ' A' ' 14' ' ' ILE . 9.4 tp -60.79 -33.6 73.23 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.051 -178.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.59 -49.57 74.74 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.647 0.261 . . . . 0.0 110.673 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.99 -41.97 88.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.015 0.436 . . . . 0.0 110.501 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.664 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 92.9 mt -54.22 -53.01 32.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.535 178.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -53.47 -21.75 6.77 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -58.26 -34.85 70.94 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.584 0.23 . . . . 0.0 111.542 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.747 HG21 ' CB ' ' A' ' 75' ' ' SER . 46.6 mm -113.05 -37.77 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 120.679 0.276 . . . . 0.0 110.815 -176.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.5 t0 -116.7 77.4 8.25 Favored Pre-proline 0 CA--C 1.536 0.416 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.469 -177.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -54.85 -20.41 22.39 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 121.505 1.47 . . . . 0.0 113.416 -177.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 44.9 p90 -92.8 15.9 13.63 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -174.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -89.68 124.69 34.82 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 173.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.9 mmtp -97.54 -40.52 8.6 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.827 -175.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -153.09 157.52 40.53 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.574 -0.45 . . . . 0.0 111.503 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 46.7 mt -95.36 138.45 21.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.068 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.5 t -91.4 -46.42 14.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.801 176.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.516 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.0 t0 -154.72 156.56 36.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.006 178.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.7 p -143.11 132.65 23.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.016 0.436 . . . . 0.0 110.986 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.7 t -108.79 128.08 54.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.869 177.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.3 m -54.62 -39.06 67.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.226 -172.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -151.53 126.61 9.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.223 0.535 . . . . 0.0 111.742 -178.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.43 HG21 ' HB3' ' A' ' 52' ' ' PHE . 97.5 t -145.19 140.38 22.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.472 -177.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.52 149.85 50.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.068 -178.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.472 ' HD2' HG21 ' A' ' 46' ' ' THR . 21.7 t80 -101.45 130.14 47.63 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.289 0.566 . . . . 0.0 111.649 -176.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.432 ' CD2' HD11 ' B' 1338 ' ' LEU . 44.4 m-85 -124.91 142.46 51.45 Favored 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.687 178.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 72.1 m -122.07 147.47 46.07 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 177.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -104.79 131.94 51.64 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.018 0.437 . . . . 0.0 110.268 175.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -104.44 116.45 32.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.885 178.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 86.4 p -68.47 -31.62 71.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.966 -177.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -62.79 -38.34 90.29 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.986 -177.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -93.89 -21.48 19.21 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 69.08 42.48 1.25 Allowed 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.246 0.546 . . . . 0.0 109.948 -178.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -153.12 166.38 32.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.124 -177.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -90.78 142.01 28.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.236 177.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -125.06 127.53 47.08 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 176.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -72.39 139.79 48.02 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 177.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.472 HG21 ' HD2' ' A' ' 33' ' ' PHE . 68.6 p -92.19 178.62 5.8 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.035 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -89.01 16.12 7.54 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.0 t -112.29 106.4 20.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-O 120.946 0.403 . . . . 0.0 110.557 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -129.75 111.25 12.46 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 173.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.67 176.61 38.97 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 120.112 -1.042 . . . . 0.0 112.157 -168.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.454 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.33 137.0 37.83 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 175.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.43 ' HB3' HG21 ' A' ' 31' ' ' VAL . 5.4 t80 -100.06 127.69 46.25 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.219 -176.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.454 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 7.1 m-85 -130.78 142.9 50.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.653 0.263 . . . . 0.0 110.319 177.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.688 HD11 HG23 ' A' ' 116' ' ' ILE . 67.4 mt -101.5 127.77 54.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 172.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.664 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.2 m-30 -108.48 137.32 46.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.939 0.4 . . . . 0.0 111.262 -175.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -117.58 143.34 46.21 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.143 176.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 51.4 ttt85 -139.85 147.53 40.81 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.8 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -86.91 28.14 0.93 Allowed 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.6 157.74 32.54 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -63.88 135.27 96.22 Favored Pre-proline 0 CA--C 1.539 0.553 0 CA-C-O 118.571 -0.728 . . . . 0.0 110.208 -176.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -66.71 140.86 51.98 Favored 'Cis proline' 0 N--CA 1.5 1.869 0 CA-C-N 121.66 1.629 . . . . 0.0 111.275 -3.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -68.14 -42.9 79.45 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.163 -176.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.431 ' CD2' HD22 ' A' ' 123' ' ' LEU . 74.6 m80 -143.03 140.58 31.04 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.622 0.725 . . . . 0.0 111.057 -176.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.8 t -150.08 152.31 34.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.056 -177.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 46.3 mt -111.48 137.71 42.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -178.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -131.83 142.03 49.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.042 -176.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.0 mt -123.44 133.75 68.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.195 0.521 . . . . 0.0 109.872 172.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -101.45 99.93 10.32 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.556 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -72.62 109.0 5.95 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 123.655 0.597 . . . . 0.0 111.037 -175.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -74.4 -40.39 62.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.2 -171.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 54.7 mt -71.19 -45.0 64.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.613 -175.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 53.2 m-20 -95.1 -3.13 48.64 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -175.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.3 p 51.17 42.2 28.51 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.439 0.638 . . . . 0.0 111.092 178.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 42.9 m -127.96 149.07 50.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.153 -0.93 . . . . 0.0 109.729 179.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.747 ' CB ' HG21 ' A' ' 17' ' ' ILE . 49.0 p -102.28 144.99 30.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.923 0.392 . . . . 0.0 111.161 -177.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -138.38 122.16 17.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.301 177.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 p -125.43 148.38 29.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.53 -0.304 . . . . 0.0 111.061 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -146.44 136.46 11.96 Favored Pre-proline 0 CA--C 1.537 0.48 0 CA-C-O 118.992 -0.528 . . . . 0.0 110.507 175.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.4 150.92 37.14 Favored 'Trans proline' 0 N--CA 1.498 1.771 0 C-N-CA 121.615 1.544 . . . . 0.0 112.484 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 71.3 mt -90.51 137.26 21.97 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-O 120.916 0.389 . . . . 0.0 110.317 177.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.9 p -132.18 155.39 48.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.708 177.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.555 ' HA2' HD22 ' A' ' 124' ' ' LEU . . . -96.45 32.0 6.92 Favored Glycine 0 CA--C 1.527 0.789 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.331 -178.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 63.4 p -100.85 -26.01 13.91 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 173.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.9 mt -69.01 147.35 51.72 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 120.889 0.375 . . . . 0.0 111.317 -176.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -116.2 135.84 53.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.638 175.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.3 mt -109.18 159.64 16.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.208 -174.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -148.9 141.36 24.26 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 178.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.8 t -98.82 109.21 22.0 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.725 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -106.85 103.61 48.0 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 172.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -71.32 139.65 35.39 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 CA-C-N 120.613 1.255 . . . . 0.0 112.012 -171.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -89.36 9.48 64.28 Favored 'Cis proline' 0 N--CA 1.5 1.897 0 CA-C-N 121.267 1.488 . . . . 0.0 113.737 -3.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -84.99 170.72 12.74 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.72 0.295 . . . . 0.0 110.858 -177.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 61.8 tp -118.75 132.75 56.15 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 170.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.8 tp -124.16 140.06 53.33 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.538 0.208 . . . . 0.0 110.583 -173.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 20.5 p90 -145.72 149.89 35.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.851 0.358 . . . . 0.0 110.562 175.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 54.5 mtm180 -106.71 148.17 28.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 -177.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -129.56 165.02 22.55 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.837 0.827 . . . . 0.0 111.433 -176.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -47.92 148.15 1.77 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.219 -177.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 54.7 ttt180 65.33 30.8 10.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.019 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 31.8 m 65.19 35.24 7.93 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.795 0.331 . . . . 0.0 111.575 165.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -99.74 145.95 27.09 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.45 HG21 ' CH2' ' B' 1345 ' ' TRP . 85.2 mt -113.7 130.36 67.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.114 0.483 . . . . 0.0 109.81 -178.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -137.91 147.71 44.65 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.433 177.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.91 168.16 25.73 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 111.373 -0.691 . . . . 0.0 111.373 -176.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -125.2 140.41 52.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.803 0.335 . . . . 0.0 110.803 -179.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 21.9 t90 -106.89 123.82 48.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.584 175.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -113.33 141.55 46.89 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.824 0.345 . . . . 0.0 110.519 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -51.31 -35.82 39.64 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.672 178.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 -135.57 135.98 40.74 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.33 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 82.7 p -63.39 -40.23 96.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.144 -177.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -60.65 -43.3 97.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.356 0.598 . . . . 0.0 110.096 178.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -56.73 -45.8 81.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.563 0.697 . . . . 0.0 109.928 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 47.7 t -60.09 -38.13 82.01 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.811 178.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -59.48 -46.6 88.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.863 0.363 . . . . 0.0 110.514 -177.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 72.2 mtm180 -60.07 -48.16 82.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.008 0.433 . . . . 0.0 110.646 -177.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.688 HG23 HD11 ' A' ' 54' ' ' ILE . 28.9 mm -58.42 -44.94 89.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.072 -178.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.2 p -59.31 -44.3 92.57 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.679 -177.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.48 -44.42 93.71 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -178.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.516 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.3 mt -58.59 -48.41 81.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.185 0.517 . . . . 0.0 110.471 -178.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.508 HG12 HD11 ' A' ' 124' ' ' LEU . 54.3 t -58.63 -43.52 87.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.185 -178.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.8 m120 -58.2 -42.66 86.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.745 -178.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.97 -42.94 99.77 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.409 -0.676 . . . . 0.0 111.409 -178.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.431 HD22 ' CD2' ' A' ' 63' ' ' HIS . 50.1 mt -64.1 -43.27 95.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.759 0.314 . . . . 0.0 111.303 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.555 HD22 ' HA2' ' A' ' 82' ' ' GLY . 24.0 mt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.385 -176.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B 1338 ' ' LEU . . . . . 0.432 HD11 ' CD2' ' A' ' 34' ' ' TYR . 11.6 mt . . . . . 0 C--O 1.233 0.201 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.1 139.61 15.18 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 121.083 1.189 . . . . 0.0 111.084 174.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -97.14 125.9 44.14 Favored Pre-proline 0 CA--C 1.535 0.396 0 CA-C-O 118.442 -0.789 . . . . 0.0 110.007 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -78.17 168.97 21.02 Favored 'Trans proline' 0 N--CA 1.496 1.643 0 C-N-CA 121.315 1.343 . . . . 0.0 111.734 176.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.91 152.55 57.12 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 C-N-CA 121.268 1.312 . . . . 0.0 111.344 177.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B 1343 ' ' LEU . . . . . 0.534 ' H ' HD12 ' B' 1343 ' ' LEU . 6.1 mp -49.97 -25.23 3.12 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -176.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 84.9 m-85 -55.34 -37.65 67.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.742 0.306 . . . . 0.0 111.167 -176.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B 1345 ' ' TRP . . . . . 0.45 ' CH2' HG21 ' A' ' 102' ' ' ILE . 58.2 t90 -61.78 -48.1 82.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.406 -176.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -62.01 -49.55 75.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.981 0.42 . . . . 0.0 110.52 -176.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -60.9 -46.05 92.18 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.083 -175.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 42.4 tp10 -59.29 -46.85 87.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.72 -175.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -61.58 -50.75 71.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.891 -176.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.5 tt0 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.373 -175.062 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.0 p . . . . . 0 C--O 1.23 0.049 0 CA-C-O 120.975 0.417 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.2 mm -59.75 -44.14 93.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.108 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 32.7 m -59.44 -45.18 92.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.534 -177.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -59.05 -45.96 89.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.369 -178.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.5 mtt -58.14 -43.92 87.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.188 0.518 . . . . 0.0 110.387 -177.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -59.95 -49.46 77.61 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.189 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.74 ' HA ' HD12 ' A' ' 14' ' ' ILE . 10.8 tp -58.79 -33.69 70.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.988 -178.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.05 -50.94 68.65 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.659 0.266 . . . . 0.0 110.891 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.85 -41.55 82.61 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.967 0.413 . . . . 0.0 110.5 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.74 HD12 ' HA ' ' A' ' 11' ' ' LEU . 88.8 mt -54.31 -52.93 34.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.627 178.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -51.43 -24.17 4.67 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt -58.56 -34.11 70.68 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 -177.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.697 HG21 ' CB ' ' A' ' 75' ' ' SER . 43.7 mm -110.22 -42.05 4.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.79 0.329 . . . . 0.0 110.239 -177.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -116.25 79.23 8.6 Favored Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.137 -178.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -53.86 -19.96 16.45 Favored 'Trans proline' 0 N--CA 1.497 1.717 0 C-N-CA 121.54 1.493 . . . . 0.0 113.498 -176.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.3 p90 -95.96 15.23 21.08 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -174.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -91.65 126.59 36.79 Favored 'General case' 0 C--N 1.333 -0.121 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 173.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.614 ' O ' HD21 ' A' ' 11' ' ' LEU . 27.6 ttmt -109.34 -38.0 5.6 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 120.835 -0.346 . . . . 0.0 111.37 -172.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -132.81 145.54 51.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.962 0.41 . . . . 0.0 111.157 -175.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.427 HD11 HD12 ' A' ' 14' ' ' ILE . 19.2 mt -100.45 133.44 43.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 171.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.1 t -90.57 -47.06 14.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.987 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.503 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.0 t0 -153.82 156.08 37.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.994 179.062 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.7 p -142.57 132.05 23.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.102 0.477 . . . . 0.0 110.917 179.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.0 t -108.52 127.37 53.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.731 177.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 86.9 p -54.78 -38.24 67.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.28 -172.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -151.19 126.36 9.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.215 0.531 . . . . 0.0 111.764 -178.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.422 HG21 ' HB3' ' A' ' 52' ' ' PHE . 97.3 t -145.28 140.12 22.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.32 -177.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -130.22 149.85 51.73 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.17 -177.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.514 ' CD2' HG21 ' A' ' 46' ' ' THR . 11.0 t80 -96.85 133.55 41.32 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.313 0.578 . . . . 0.0 111.638 -176.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -125.77 140.91 52.29 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.404 177.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 86.2 m -123.0 144.06 49.51 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 177.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -105.31 130.24 53.48 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.901 0.381 . . . . 0.0 110.155 175.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -101.56 115.52 30.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.785 176.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.5 m -67.48 -33.18 74.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.895 -177.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.3 m -61.54 -38.08 86.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.631 0.253 . . . . 0.0 111.021 -177.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -94.92 -21.37 18.69 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 22.5 t30 68.99 45.44 0.92 Allowed 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.519 0.676 . . . . 0.0 109.558 -177.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 74.5 tt0 -155.96 151.63 27.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.203 -177.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 88.8 m95 -84.32 142.46 30.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.123 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -125.02 131.49 53.38 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.01 -0.366 . . . . 0.0 110.01 176.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 55.8 pttt -74.87 136.79 41.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.277 178.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.514 HG21 ' CD2' ' A' ' 33' ' ' PHE . 72.4 p -92.31 168.46 11.3 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.775 -0.37 . . . . 0.0 110.285 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -74.22 -18.49 60.74 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.5 t -75.51 106.39 5.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-O 121.042 0.448 . . . . 0.0 110.457 -178.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -133.29 110.95 10.43 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 174.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.61 176.54 38.92 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 120.277 -0.963 . . . . 0.0 112.252 -168.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.462 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.39 135.48 37.45 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 174.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.422 ' HB3' HG21 ' A' ' 31' ' ' VAL . 5.3 t80 -99.12 127.48 45.08 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.134 -176.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.462 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 7.1 m-85 -130.72 142.4 50.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.297 177.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.674 HD11 HG23 ' A' ' 116' ' ' ILE . 66.5 mt -101.54 127.51 54.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 172.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.667 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.8 m-30 -108.47 136.22 48.46 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.994 0.426 . . . . 0.0 111.394 -175.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 79.0 t60 -112.05 143.34 43.22 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.247 174.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -142.01 146.58 35.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.041 178.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -86.89 28.04 0.94 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.267 -0.424 . . . . 0.0 112.081 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.6 169.53 24.21 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -64.02 125.29 87.67 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-O 118.441 -0.79 . . . . 0.0 110.018 -178.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -78.39 141.0 63.19 Favored 'Cis proline' 0 N--CA 1.497 1.677 0 CA-C-N 121.92 1.721 . . . . 0.0 111.831 -1.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -64.9 -41.5 95.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.993 -177.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -142.71 136.97 29.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.365 0.602 . . . . 0.0 110.935 -177.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.1 t -150.55 152.35 34.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.38 -178.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.419 HG13 HD11 ' A' ' 80' ' ' ILE . 43.0 mt -111.15 138.44 39.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 -178.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -131.88 142.0 49.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.955 -176.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 62.8 mt -123.5 132.76 70.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.255 0.55 . . . . 0.0 109.784 172.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -99.15 99.52 10.52 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.234 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 56.8 t-20 -76.56 107.82 9.1 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 121.748 0.785 . . . . 0.0 110.86 -174.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 60.7 ttm-85 -73.41 -35.98 65.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.516 -170.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.6 mt -71.47 -45.35 62.78 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.999 -173.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 42.1 p-10 -95.2 -3.35 47.9 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -177.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.7 m 58.32 44.25 18.8 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.497 0.665 . . . . 0.0 109.97 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 29.3 m -134.35 149.06 50.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.224 -177.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.697 ' CB ' HG21 ' A' ' 17' ' ' ILE . 10.8 p -101.85 144.99 29.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.283 -177.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -137.31 122.24 18.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.444 177.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 13.0 p -125.42 149.22 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-O 120.933 0.397 . . . . 0.0 111.177 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -147.83 131.35 8.26 Favored Pre-proline 0 CA--C 1.538 0.513 0 CA-C-O 118.747 -0.644 . . . . 0.0 110.241 176.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -75.35 150.84 37.25 Favored 'Trans proline' 0 N--CA 1.5 1.872 0 C-N-CA 121.475 1.45 . . . . 0.0 112.432 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.419 HD11 HG13 ' A' ' 65' ' ' ILE . 62.5 mt -90.69 123.01 42.67 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-O 120.846 0.355 . . . . 0.0 110.488 179.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 73.0 p -99.66 154.61 18.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.869 174.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -92.69 24.14 25.1 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.868 -179.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 38.8 p -111.03 -9.91 14.38 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 175.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.9 mt -67.74 140.39 56.72 Favored 'General case' 0 C--O 1.232 0.142 0 O-C-N 122.112 -0.367 . . . . 0.0 111.275 -176.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.9 tt0 -113.48 135.81 53.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.853 176.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 61.3 mt -113.61 161.31 17.59 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.75 -176.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -149.99 143.71 25.37 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.3 t -99.69 109.25 21.73 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.515 179.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -106.75 103.75 48.29 Favored Pre-proline 0 C--N 1.329 -0.321 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 173.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -67.92 140.1 49.36 Favored 'Trans proline' 0 N--CA 1.496 1.647 0 CA-C-N 120.403 1.179 . . . . 0.0 111.784 -172.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -89.76 9.24 64.61 Favored 'Cis proline' 0 N--CA 1.5 1.899 0 CA-C-N 121.239 1.478 . . . . 0.0 113.699 -5.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -89.58 172.79 8.71 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.607 0.241 . . . . 0.0 110.815 -176.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.8 tp -115.95 136.38 53.1 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 172.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 11.6 tp -129.5 140.64 51.2 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.617 0.246 . . . . 0.0 110.654 -174.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -146.39 157.32 43.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.808 0.337 . . . . 0.0 110.418 175.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.4 mtm105 -101.88 144.79 30.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.629 -177.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -127.49 163.02 25.03 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.951 0.881 . . . . 0.0 111.854 -176.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -47.77 149.98 1.16 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.36 -0.837 . . . . 0.0 112.177 -177.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 93.0 mtt180 62.21 30.8 17.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.158 -0.928 . . . . 0.0 112.102 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 69.6 m 65.74 35.23 6.97 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.866 0.365 . . . . 0.0 111.487 165.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 68.1 mtp180 -101.23 151.37 21.94 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 78.5 mt -111.37 126.75 68.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 -178.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 32.9 mtp180 -130.82 145.35 51.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.658 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -140.84 167.98 25.44 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -127.96 141.71 51.45 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.952 0.406 . . . . 0.0 110.882 -178.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 70.8 t90 -106.72 124.67 49.95 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.518 175.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -114.01 140.43 48.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.677 0.275 . . . . 0.0 110.512 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 68.9 t80 -51.7 -36.72 47.84 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.665 178.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 37.3 t-20 -134.46 135.66 42.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.438 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.3 m -61.22 -42.05 97.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.07 -177.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -59.85 -43.4 94.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.399 0.619 . . . . 0.0 110.136 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -56.78 -44.87 82.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.49 0.662 . . . . 0.0 110.079 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 45.9 t -59.7 -39.83 85.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.673 178.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -58.79 -44.86 90.83 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.848 0.356 . . . . 0.0 110.669 -177.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -60.79 -49.79 76.07 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.73 -177.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.674 HG23 HD11 ' A' ' 54' ' ' ILE . 32.9 mm -58.47 -44.57 89.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.051 0.453 . . . . 0.0 109.982 -178.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 60.1 p -59.79 -44.16 94.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.677 -177.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.66 -43.69 94.28 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.67 -0.972 . . . . 0.0 110.67 -178.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.503 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.1 mt -59.18 -49.01 79.49 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.118 0.485 . . . . 0.0 110.617 -178.308 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 53.8 t -58.9 -43.51 88.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.083 -178.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -58.03 -42.52 85.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.865 0.364 . . . . 0.0 110.674 -178.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.97 -41.47 99.66 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 -179.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 36.3 mt -62.5 -43.16 99.5 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.878 0.371 . . . . 0.0 111.119 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 79.9 mt . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.618 -176.739 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 13.2 mt . . . . . 0 CA--C 1.531 0.219 0 CA-C-O 119.04 -0.505 . . . . 0.0 109.762 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -79.19 139.93 15.25 Favored 'Trans proline' 0 N--CA 1.493 1.475 0 C-N-CA 121.178 1.252 . . . . 0.0 111.33 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 25.4 mmtp -97.16 125.69 44.87 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-O 118.85 -0.595 . . . . 0.0 109.798 178.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 9.4 Cg_exo -74.18 158.32 45.39 Favored 'Trans proline' 0 N--CA 1.497 1.732 0 C-N-CA 121.464 1.442 . . . . 0.0 112.11 172.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -53.63 157.11 10.3 Favored 'Trans proline' 0 N--CA 1.496 1.639 0 C-N-CA 121.381 1.387 . . . . 0.0 111.932 178.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 80.7 mt -49.98 -28.17 6.48 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -177.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -54.74 -37.58 66.09 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.922 0.391 . . . . 0.0 111.126 -177.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 41.9 t90 -60.85 -47.96 84.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.244 -178.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -59.93 -46.65 88.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.992 0.425 . . . . 0.0 110.307 -177.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -59.23 -45.97 89.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.661 -177.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -57.74 -44.71 86.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.573 -177.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.19 -47.56 85.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.673 -177.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 . . . . . 0 C--N 1.327 -0.406 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.828 -177.103 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.4 m . . . . . 0 CA--C 1.526 0.056 0 CA-C-O 120.924 0.393 . . . . 0.0 110.498 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.3 mm -59.64 -44.76 94.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.088 -179.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.4 m -59.25 -45.2 91.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.986 0.422 . . . . 0.0 110.481 -177.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.0 mmt180 -58.99 -45.72 89.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.468 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.8 mtt -58.26 -43.79 88.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.121 0.486 . . . . 0.0 110.44 -178.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -59.28 -48.37 81.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.21 -178.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.651 ' HA ' HD12 ' A' ' 14' ' ' ILE . 9.4 tp -60.36 -33.39 72.36 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.146 -179.274 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.91 -49.77 74.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.677 0.275 . . . . 0.0 110.662 179.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.06 -41.95 89.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.974 0.416 . . . . 0.0 110.434 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.658 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 93.5 mt -54.28 -52.85 34.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.627 178.349 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -51.85 -27.29 12.13 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -177.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -58.94 -32.81 69.93 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -177.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.1 mm -106.17 -44.95 8.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.026 0.441 . . . . 0.0 110.064 -177.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -117.12 79.16 10.56 Favored Pre-proline 0 CA--C 1.535 0.4 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.276 -177.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -54.32 -20.22 19.29 Favored 'Trans proline' 0 N--CA 1.497 1.721 0 C-N-CA 121.473 1.449 . . . . 0.0 113.561 -175.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 14.5 p90 -93.52 15.13 16.74 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -174.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -81.28 128.12 33.46 Favored 'General case' 0 C--N 1.334 -0.1 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 173.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -97.51 -40.36 8.7 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.704 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -159.03 159.88 35.22 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.679 -0.409 . . . . 0.0 111.408 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 39.8 mt -96.22 138.39 21.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.052 178.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.9 t -90.87 -47.21 14.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.856 176.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.497 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.0 t0 -154.0 158.13 40.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.933 178.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 18.6 p -143.89 133.24 23.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.971 0.415 . . . . 0.0 111.153 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.3 t -110.12 127.8 55.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.74 177.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.4 m -54.86 -39.75 68.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.206 -171.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -149.81 125.91 10.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.262 0.553 . . . . 0.0 111.818 -178.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.442 HG21 ' HB3' ' A' ' 52' ' ' PHE . 97.2 t -145.19 142.25 22.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.447 -177.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.59 149.84 51.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.164 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -99.01 131.43 45.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.233 0.539 . . . . 0.0 111.519 -177.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -125.82 144.23 50.73 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.807 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 80.4 m -121.32 148.56 44.17 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -109.8 130.84 55.48 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.874 0.368 . . . . 0.0 110.452 176.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 36.9 t-20 -101.07 113.0 25.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.834 176.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.1 m -67.5 -32.73 73.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.976 -177.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.5 m -62.31 -38.52 89.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.666 0.269 . . . . 0.0 111.043 -177.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -94.72 -21.41 18.77 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -178.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 27.2 t30 68.74 45.76 0.99 Allowed 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.485 0.659 . . . . 0.0 109.356 -177.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -151.42 151.23 31.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.07 -176.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.42 ' CB ' HD12 ' B' 1338 ' ' LEU . 81.0 m95 -87.65 141.28 28.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.341 177.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -125.02 130.47 52.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.17 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -76.47 139.93 41.03 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.9 p -92.31 177.42 6.15 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.13 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.7 p30 -86.98 12.96 10.02 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.9 t -106.62 106.44 20.62 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-O 120.988 0.423 . . . . 0.0 110.377 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -130.1 112.55 13.53 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 174.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.56 38.96 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 120.157 -1.02 . . . . 0.0 112.148 -168.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.456 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -79.77 135.42 36.49 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 175.383 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.442 ' HB3' HG21 ' A' ' 31' ' ' VAL . 6.3 t80 -98.27 129.22 44.99 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.113 -176.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.456 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.6 m-85 -132.57 143.4 49.68 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.103 177.4 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.718 HD11 HG23 ' A' ' 116' ' ' ILE . 69.9 mt -101.57 128.12 54.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 172.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.658 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 13.4 m-30 -108.42 135.91 48.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.991 0.424 . . . . 0.0 111.247 -175.011 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 83.4 t60 -116.37 143.35 45.66 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.917 176.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -141.98 148.18 38.16 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.121 179.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -86.82 28.06 0.93 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 116.264 -0.426 . . . . 0.0 112.059 179.174 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.72 162.57 38.57 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 24.8 mp0 -64.06 130.7 94.67 Favored Pre-proline 0 CA--C 1.539 0.535 0 CA-C-O 118.517 -0.754 . . . . 0.0 110.031 -177.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.46 140.93 69.28 Favored 'Cis proline' 0 N--CA 1.498 1.739 0 CA-C-N 121.795 1.677 . . . . 0.0 111.63 -1.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -65.6 -42.69 91.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.04 -177.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.409 ' CD2' HD22 ' A' ' 123' ' ' LEU . 65.4 m80 -141.8 139.04 32.64 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.426 0.631 . . . . 0.0 110.917 -176.526 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.2 t -150.79 151.96 33.11 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.294 -178.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.7 mt -108.33 139.14 31.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -179.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.402 ' CD2' HG22 ' A' ' 77' ' ' VAL . 32.8 t80 -131.8 141.99 49.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.741 -176.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.0 mt -127.15 129.96 71.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-O 121.204 0.526 . . . . 0.0 110.048 173.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -96.17 99.52 11.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.539 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.2 t-20 -71.12 105.23 3.3 Favored 'General case' 0 C--N 1.332 -0.182 0 O-C-N 123.66 0.6 . . . . 0.0 110.8 -176.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 77.0 mtp85 -73.58 -38.62 65.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.489 -170.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 62.8 mt -75.15 -45.2 42.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.658 -174.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -95.13 -3.26 48.28 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 -175.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.427 HG22 ' O ' ' A' ' 73' ' ' THR . 11.9 m 54.89 43.11 30.48 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 121.441 0.638 . . . . 0.0 110.652 177.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.3 m -125.98 148.63 49.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.579 -177.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 76.2 p -94.74 130.27 41.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.127 -179.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -123.51 122.27 37.78 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 174.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.402 HG22 ' CD2' ' A' ' 66' ' ' PHE . 39.5 t -125.53 147.05 30.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.796 -176.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -146.6 126.45 6.77 Favored Pre-proline 0 CA--C 1.539 0.554 0 CA-C-O 118.683 -0.675 . . . . 0.0 110.37 174.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -75.37 150.89 37.24 Favored 'Trans proline' 0 N--CA 1.498 1.762 0 C-N-CA 121.471 1.447 . . . . 0.0 112.418 178.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 67.3 mt -93.59 138.78 19.55 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 CA-C-O 120.967 0.413 . . . . 0.0 110.263 178.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.429 ' OG1' HD23 ' A' ' 84' ' ' LEU . 60.2 p -132.17 157.16 44.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.688 177.019 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -90.91 31.81 5.43 Favored Glycine 0 CA--C 1.528 0.854 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.296 -178.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 54.5 p -111.07 -17.99 13.13 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 174.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.429 HD23 ' OG1' ' A' ' 81' ' ' THR . 4.5 mm? -67.82 141.52 56.46 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-O 120.926 0.393 . . . . 0.0 110.976 -175.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.7 tt0 -111.96 135.91 51.98 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.661 175.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 68.9 mt -115.39 156.92 24.67 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.945 0.402 . . . . 0.0 110.984 -176.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -148.85 142.4 25.39 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 177.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.0 t -99.05 109.14 21.91 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.668 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -106.8 103.71 48.3 Favored Pre-proline 0 C--N 1.328 -0.34 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 172.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -70.03 140.3 41.34 Favored 'Trans proline' 0 N--CA 1.497 1.699 0 CA-C-N 120.468 1.203 . . . . 0.0 112.013 -171.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -89.8 9.92 62.85 Favored 'Cis proline' 0 N--CA 1.501 1.922 0 CA-C-N 121.317 1.506 . . . . 0.0 113.756 -4.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -88.22 170.21 11.21 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.694 0.283 . . . . 0.0 110.981 -177.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 55.9 tp -116.55 133.77 55.62 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 171.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.484 HD11 ' CG2' ' A' ' 102' ' ' ILE . 10.7 tp -125.37 139.09 53.98 Favored 'General case' 0 C--N 1.333 -0.137 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 -174.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -143.93 151.96 40.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.998 0.428 . . . . 0.0 110.65 175.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 30.3 mtm180 -104.47 144.09 32.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.668 -177.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -129.09 166.5 19.15 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.917 0.865 . . . . 0.0 111.811 -176.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -47.7 148.29 1.58 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.279 -176.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 63.41 30.85 15.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.126 -0.943 . . . . 0.0 112.256 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 67.3 m 65.67 35.25 7.08 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.848 0.356 . . . . 0.0 111.526 166.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 27.7 mmt180 -99.26 145.9 26.78 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.708 HD13 ' CH2' ' B' 1345 ' ' TRP . 82.7 mt -114.93 127.47 72.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 121.088 0.47 . . . . 0.0 109.792 -178.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -136.78 150.33 48.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.506 179.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.52 169.47 25.13 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 111.41 -0.676 . . . . 0.0 111.41 -175.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -125.21 138.56 54.12 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.998 0.428 . . . . 0.0 110.625 -178.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -106.45 120.37 41.74 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.893 -1.049 . . . . 0.0 109.583 177.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -112.77 139.75 48.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.809 0.337 . . . . 0.0 110.719 -178.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -51.58 -37.51 50.18 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.63 178.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.6 t-20 -132.96 135.65 45.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.764 0.316 . . . . 0.0 110.431 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.7 t -61.36 -42.05 98.07 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.051 -177.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 -59.65 -43.23 94.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.362 0.601 . . . . 0.0 110.152 178.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -56.91 -45.01 82.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.432 0.634 . . . . 0.0 109.998 178.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 46.5 t -59.51 -39.75 84.84 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.588 178.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -59.51 -45.41 91.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.8 0.334 . . . . 0.0 110.704 -177.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 -60.11 -49.35 78.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.054 0.454 . . . . 0.0 110.663 -177.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.718 HG23 HD11 ' A' ' 54' ' ' ILE . 31.7 mm -58.42 -44.86 89.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.974 -178.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 55.8 p -59.31 -43.97 92.61 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.708 -177.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.61 -44.03 94.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -178.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.497 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.7 mt -58.47 -48.68 79.98 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.234 0.54 . . . . 0.0 110.514 -178.737 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 52.7 t -58.71 -43.13 87.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.156 -178.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 26.9 m120 -58.34 -42.35 86.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.849 0.357 . . . . 0.0 110.664 -178.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.77 -41.16 99.58 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.409 HD22 ' CD2' ' A' ' 63' ' ' HIS . 50.3 mt -63.97 -45.01 91.02 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.794 0.33 . . . . 0.0 111.18 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 36.1 mt . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.295 -176.246 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B 1338 ' ' LEU . . . . . 0.42 HD12 ' CB ' ' A' ' 43' ' ' TRP . 21.9 mt . . . . . 0 C--O 1.233 0.198 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -78.99 139.66 15.41 Favored 'Trans proline' 0 N--CA 1.491 1.364 0 C-N-CA 120.915 1.076 . . . . 0.0 111.201 175.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 5.4 mmmm -97.28 125.93 43.73 Favored Pre-proline 0 CA--C 1.536 0.432 0 CA-C-O 118.456 -0.783 . . . . 0.0 109.966 178.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -78.18 168.47 21.76 Favored 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 121.257 1.305 . . . . 0.0 111.937 175.387 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -65.71 154.57 73.25 Favored 'Trans proline' 0 N--CA 1.495 1.562 0 C-N-CA 121.259 1.306 . . . . 0.0 111.305 175.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.3 tp -50.01 -29.62 9.01 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -176.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 65.3 t80 -54.96 -36.83 65.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.818 0.342 . . . . 0.0 111.349 -176.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B 1345 ' ' TRP . . . . . 0.708 ' CH2' HD13 ' A' ' 102' ' ' ILE . 23.6 t90 -61.53 -48.15 82.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.423 -176.402 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -61.89 -49.15 77.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.121 0.486 . . . . 0.0 110.366 -178.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -58.82 -44.96 90.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.871 -176.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -59.04 -46.84 87.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.623 -176.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.38 -47.19 86.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.052 0.453 . . . . 0.0 110.652 -177.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 . . . . . 0 C--N 1.328 -0.366 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.013 -176.264 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.1 t . . . . . 0 CA--C 1.527 0.062 0 CA-C-O 120.904 0.383 . . . . 0.0 110.662 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.6 mm -59.93 -45.31 95.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.199 -178.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.9 m -59.14 -44.62 92.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.467 -178.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -59.43 -46.15 89.54 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.593 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 88.4 mtp -58.17 -43.72 87.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.053 0.454 . . . . 0.0 110.423 -178.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -59.99 -48.65 80.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.268 -178.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.629 ' HA ' HD12 ' A' ' 14' ' ' ILE . 9.8 tp -60.72 -32.89 72.13 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.729 -0.388 . . . . 0.0 111.175 -179.094 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.22 -49.86 74.08 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.726 0.298 . . . . 0.0 110.632 179.003 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.8 -42.13 88.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.057 0.456 . . . . 0.0 110.456 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.715 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 97.7 mt -54.28 -52.88 34.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.627 178.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -53.26 -23.7 9.58 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -57.93 -34.65 70.11 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 120.611 0.244 . . . . 0.0 111.575 -178.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 48.0 mm -107.77 -42.83 6.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.973 0.416 . . . . 0.0 110.208 -177.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -117.16 77.43 9.39 Favored Pre-proline 0 CA--C 1.535 0.372 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.808 -179.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -55.72 -21.19 31.13 Favored 'Trans proline' 0 N--CA 1.498 1.752 0 C-N-CA 121.524 1.482 . . . . 0.0 113.447 -174.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.7 p90 -87.47 -2.15 58.42 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -174.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.33 127.21 31.34 Favored 'General case' 0 N--CA 1.461 0.095 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 177.133 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -97.54 -40.35 8.69 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.653 -175.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -154.79 157.44 37.95 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.3 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 35.4 mt -93.87 136.75 24.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.824 177.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.5 t -87.41 -44.98 16.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.68 177.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.504 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -158.35 157.94 33.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.845 178.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.2 p -142.87 132.9 24.32 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.999 0.428 . . . . 0.0 111.266 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.6 t -109.98 125.74 53.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.663 176.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.1 m -54.84 -38.93 68.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.169 -172.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -148.89 126.45 11.67 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.247 0.546 . . . . 0.0 111.76 -178.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.498 HG22 ' CD1' ' A' ' 107' ' ' PHE . 97.3 t -145.2 140.19 22.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.333 -178.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.91 149.84 51.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.722 0.296 . . . . 0.0 111.268 -177.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.481 ' HD2' HG21 ' A' ' 46' ' ' THR . 25.6 t80 -100.77 130.33 46.78 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.549 -176.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -126.23 143.96 50.95 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.73 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 96.2 m -123.51 146.73 47.86 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -108.64 132.0 54.33 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.962 0.41 . . . . 0.0 110.333 176.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -105.18 114.22 28.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.82 176.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 84.8 p -70.8 -29.69 65.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.0 -0.546 . . . . 0.0 112.338 -175.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.3 t -58.9 -39.23 80.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.805 0.336 . . . . 0.0 110.943 -177.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -100.58 -17.88 16.86 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.9 t30 69.82 48.05 0.59 Allowed 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.596 0.712 . . . . 0.0 109.46 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -153.57 151.62 29.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.774 -178.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -88.37 142.78 27.45 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.393 178.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -124.99 130.39 52.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.86 176.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.5 pttp -75.02 141.26 43.94 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 177.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.481 HG21 ' HD2' ' A' ' 33' ' ' PHE . 67.5 p -92.3 175.55 6.8 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.699 -0.401 . . . . 0.0 110.067 -179.019 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -85.31 13.28 6.72 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.7 t -107.95 106.36 20.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-O 121.014 0.435 . . . . 0.0 110.351 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -132.1 112.2 12.12 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 174.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.64 176.53 38.95 Favored Glycine 0 CA--C 1.52 0.389 0 C-N-CA 120.184 -1.007 . . . . 0.0 112.222 -168.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.494 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.97 135.37 36.91 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 175.198 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.445 ' HB3' HG21 ' A' ' 31' ' ' VAL . 7.0 t80 -98.94 127.75 44.94 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.107 -176.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.494 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 9.2 m-85 -131.75 141.97 49.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.331 177.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.64 HD11 HG23 ' A' ' 116' ' ' ILE . 63.9 mt -101.59 129.24 53.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 173.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.715 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 10.3 m-30 -108.49 137.38 46.54 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.791 0.329 . . . . 0.0 111.213 -175.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 57.6 t60 -121.35 143.3 49.27 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.289 176.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 29.1 ttp180 -142.01 153.84 44.56 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.303 177.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -86.85 28.17 0.92 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.152 -179.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -155.78 152.87 29.0 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -63.95 133.55 95.62 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-O 118.5 -0.762 . . . . 0.0 110.243 -176.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -68.19 140.92 57.98 Favored 'Cis proline' 0 N--CA 1.499 1.794 0 CA-C-N 121.703 1.644 . . . . 0.0 111.45 -0.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -66.74 -41.32 88.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.135 -176.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.414 ' HB3' HD12 ' A' ' 80' ' ' ILE . 74.0 m80 -142.44 143.42 32.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.7 0.762 . . . . 0.0 111.249 -175.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.6 t -150.31 151.95 33.72 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.847 -179.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 48.2 mt -112.35 138.4 41.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 -177.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -131.79 142.09 49.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.03 -177.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.8 mt -123.06 131.87 72.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.252 0.549 . . . . 0.0 109.783 172.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -97.8 99.58 10.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.426 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -72.03 107.28 4.66 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 123.618 0.573 . . . . 0.0 110.992 -175.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -73.4 -41.96 62.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.278 -171.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 74.7 mt -70.3 -45.13 66.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.671 -175.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 39.9 m-20 -95.09 -3.23 48.48 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -175.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.8 p 51.07 42.31 28.43 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.523 0.678 . . . . 0.0 111.065 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 38.5 m -125.2 149.08 48.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.164 -179.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.4 p -98.2 137.73 36.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.999 -178.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -132.97 122.19 23.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.118 175.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 p -125.62 150.38 30.89 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.049 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -148.71 132.8 8.68 Favored Pre-proline 0 CA--C 1.538 0.503 0 CA-C-O 118.879 -0.581 . . . . 0.0 110.401 174.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -75.46 150.95 36.93 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 121.578 1.518 . . . . 0.0 112.29 179.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.414 HD12 ' HB3' ' A' ' 63' ' ' HIS . 69.7 mt -90.51 136.31 24.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.2 177.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.6 p -132.14 158.49 41.53 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.839 177.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -95.7 35.46 4.3 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.058 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.3 p -109.0 -23.33 11.74 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 173.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.89 147.68 51.34 Favored 'General case' 0 C--O 1.231 0.082 0 CA-C-O 120.887 0.375 . . . . 0.0 111.207 -176.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 59.3 tt0 -118.56 135.91 54.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.799 175.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 51.6 mt -114.25 161.05 18.34 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.715 -176.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -150.06 142.68 24.53 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 177.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.0 t -98.5 109.15 21.95 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.444 -0.502 . . . . 0.0 110.588 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 -106.9 103.75 48.74 Favored Pre-proline 0 C--N 1.328 -0.344 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 171.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -70.26 143.15 47.59 Favored 'Trans proline' 0 N--CA 1.497 1.734 0 CA-C-N 120.496 1.213 . . . . 0.0 112.003 -171.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -91.17 14.73 49.52 Favored 'Cis proline' 0 N--CA 1.499 1.798 0 CA-C-N 120.964 1.38 . . . . 0.0 113.561 -3.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -97.0 172.64 7.73 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.458 0.171 . . . . 0.0 110.58 -177.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 52.5 tp -114.5 135.07 54.52 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 173.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.419 HD21 ' HZ2' ' B' 1345 ' ' TRP . 9.4 tp -127.17 139.56 52.87 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 -174.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 19.6 p90 -146.61 160.9 41.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.91 0.386 . . . . 0.0 110.614 175.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 30.5 mtm105 -101.9 146.15 28.24 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.471 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 36.3 t30 -127.26 164.64 21.27 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.78 0.8 . . . . 0.0 111.732 -176.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -48.0 147.51 2.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.203 -176.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 63.23 30.95 15.78 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.152 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 46.5 t 66.62 35.2 5.45 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.896 0.379 . . . . 0.0 111.583 166.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -100.74 152.63 20.25 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 73.9 mt -110.19 129.18 65.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 -179.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -138.3 150.25 46.45 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.789 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -144.29 169.34 26.38 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 111.359 -0.696 . . . . 0.0 111.359 -176.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -125.34 140.96 52.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.948 0.404 . . . . 0.0 110.809 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 17.2 t90 -108.38 127.74 54.15 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.81 175.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.498 ' CD1' HG22 ' A' ' 31' ' ' VAL . 79.4 m-85 -115.26 142.02 47.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.762 0.315 . . . . 0.0 110.356 178.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -50.93 -38.25 49.05 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.78 178.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -133.39 137.27 45.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.309 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.0 m -59.81 -41.74 91.92 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.957 -177.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -58.17 -42.24 85.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.285 0.564 . . . . 0.0 110.18 178.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -57.26 -44.78 84.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.508 0.67 . . . . 0.0 109.909 178.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 43.5 t -59.22 -37.01 76.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.797 176.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -63.11 -51.73 65.39 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 121.208 -0.197 . . . . 0.0 111.182 -174.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 29.6 ptt180 -64.76 -42.41 95.14 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.35 -0.54 . . . . 0.0 111.339 -175.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.64 HG23 HD11 ' A' ' 54' ' ' ILE . 26.5 mm -60.04 -48.13 89.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.175 0 C-N-CA 120.507 -0.477 . . . . 0.0 109.883 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 66.5 p -59.32 -43.2 92.71 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.832 0.349 . . . . 0.0 110.644 -177.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.77 -43.73 94.47 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.631 -0.987 . . . . 0.0 110.631 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.504 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.1 mt -57.93 -47.78 81.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.214 0.531 . . . . 0.0 110.497 -178.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 49.3 t -59.01 -44.14 90.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.035 -179.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -57.36 -42.74 82.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.689 -178.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.12 -46.02 95.37 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.006 -0.838 . . . . 0.0 111.006 -178.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 56.9 mt -57.83 -43.07 85.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.016 0.436 . . . . 0.0 110.507 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 39.3 mt . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.802 -179.838 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 8.3 mt . . . . . 0 CA--C 1.533 0.307 0 CA-C-O 118.169 -0.92 . . . . 0.0 109.412 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -79.14 139.55 15.08 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 CA-C-N 120.615 1.255 . . . . 0.0 111.155 174.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 41.6 mtmt -97.38 126.02 43.21 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-O 118.453 -0.784 . . . . 0.0 110.32 179.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -64.55 167.8 14.38 Favored 'Trans proline' 0 N--CA 1.498 1.757 0 CA-C-N 120.564 1.237 . . . . 0.0 111.619 175.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -56.55 157.11 19.74 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 121.402 1.401 . . . . 0.0 111.445 178.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 12.3 tp -50.01 -29.96 9.68 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -176.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 58.2 t80 -54.95 -37.42 66.43 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.921 0.391 . . . . 0.0 111.161 -177.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B 1345 ' ' TRP . . . . . 0.419 ' HZ2' HD21 ' A' ' 94' ' ' LEU . 43.6 t90 -60.2 -48.05 83.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.225 -177.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -61.88 -47.94 82.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.026 0.441 . . . . 0.0 110.626 -177.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -59.63 -45.09 93.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.86 -177.099 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 42.7 tp10 -59.23 -46.17 89.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.695 -176.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.26 -48.34 82.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.039 0.447 . . . . 0.0 110.751 -177.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 . . . . . 0 C--N 1.328 -0.359 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.15 -176.597 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.4 m . . . . . 0 CA--C 1.527 0.064 0 CA-C-O 120.908 0.385 . . . . 0.0 110.639 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.7 mm -59.56 -44.82 94.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.128 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.5 m -58.62 -45.07 90.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.061 0.458 . . . . 0.0 110.439 -178.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -59.26 -45.38 91.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.58 -178.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 89.2 mtp -58.27 -42.4 86.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.449 -178.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -60.1 -49.93 75.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.287 -178.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.736 ' HA ' HD12 ' A' ' 14' ' ' ILE . 12.7 tp -60.53 -31.02 70.12 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.323 -179.303 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.76 -50.92 67.17 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.676 0.274 . . . . 0.0 110.733 178.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.36 -40.23 81.7 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.953 0.406 . . . . 0.0 110.674 179.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.736 HD12 ' HA ' ' A' ' 11' ' ' LEU . 97.7 mt -54.24 -52.9 33.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.485 177.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -51.55 -22.38 3.2 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.9 mmtt -58.72 -35.09 72.12 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 122.296 -0.253 . . . . 0.0 111.631 -178.097 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 48.2 mm -108.19 -43.26 6.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.908 0.385 . . . . 0.0 110.116 -177.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -117.36 77.3 9.98 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.129 -176.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -54.84 -22.45 29.86 Favored 'Trans proline' 0 N--CA 1.498 1.747 0 C-N-CA 121.5 1.466 . . . . 0.0 113.33 -176.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.0 p90 -88.65 8.74 27.02 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -175.011 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -88.61 123.81 33.44 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 174.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.475 ' O ' HD21 ' A' ' 11' ' ' LEU . 28.4 mmtp -104.86 -40.06 6.07 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.991 -173.107 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -132.02 145.63 51.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.145 -176.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.434 HG13 HD13 ' A' ' 11' ' ' LEU . 63.0 mt -96.66 128.13 48.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.87 -0.604 . . . . 0.0 109.731 173.117 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.3 t -89.26 -47.11 15.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.047 0.451 . . . . 0.0 109.965 -179.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.478 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.1 t0 -154.22 150.26 27.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.023 177.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.8 p -138.46 131.95 30.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.059 0.456 . . . . 0.0 110.743 179.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.4 t -104.74 126.9 52.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.482 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.2 m -53.91 -38.03 64.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.366 -171.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -151.92 127.82 10.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.225 0.536 . . . . 0.0 111.724 -178.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.424 HG22 ' CD2' ' A' ' 107' ' ' PHE . 94.9 t -145.15 136.99 20.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.542 -177.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -126.36 149.86 48.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.173 -178.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.682 ' CD2' HG21 ' A' ' 46' ' ' THR . 36.3 t80 -96.99 133.09 42.12 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.334 0.588 . . . . 0.0 111.788 -176.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -127.04 137.98 53.15 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.283 177.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.4 m -119.03 143.46 47.08 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 178.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -107.93 130.57 55.02 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.008 0.432 . . . . 0.0 110.246 177.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -101.76 113.74 27.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.063 176.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 86.1 p -70.88 -25.79 62.95 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -177.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.0 m -58.89 -36.4 74.61 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 121.121 -0.232 . . . . 0.0 111.244 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -113.95 -12.04 12.7 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -177.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 58.7 t30 69.74 50.51 0.49 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-O 121.704 0.764 . . . . 0.0 109.592 179.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.7 tp10 -148.01 146.93 29.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.908 -178.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.453 ' CB ' HD12 ' B' 1338 ' ' LEU . 83.7 m95 -89.2 141.0 28.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.176 176.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -121.42 126.31 49.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.229 -0.441 . . . . 0.0 109.916 176.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -73.17 135.14 44.6 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 177.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.682 HG21 ' CD2' ' A' ' 33' ' ' PHE . 67.9 p -92.35 162.1 14.4 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.24 -177.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -75.95 5.68 6.21 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.3 t -97.16 106.42 18.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 121.091 0.472 . . . . 0.0 110.29 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -131.73 115.5 16.09 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 176.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.5 38.96 Favored Glycine 0 CA--C 1.52 0.392 0 C-N-CA 120.063 -1.065 . . . . 0.0 112.392 -169.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.5 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -80.94 136.47 36.04 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -102.18 123.8 46.65 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -175.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.5 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 4.5 m-85 -128.53 140.92 51.55 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.644 0.259 . . . . 0.0 110.721 177.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.492 HD11 HG23 ' A' ' 116' ' ' ILE . 74.8 mt -101.63 127.35 55.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 170.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.591 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 11.2 m-30 -108.53 140.62 41.61 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.018 0.437 . . . . 0.0 111.665 -177.35 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -108.82 143.38 38.08 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.934 173.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -140.89 145.51 36.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.028 178.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -86.93 28.17 0.93 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.217 -0.447 . . . . 0.0 112.03 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.28 164.15 36.7 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -63.96 128.83 93.44 Favored Pre-proline 0 CA--C 1.539 0.557 0 CA-C-O 118.401 -0.809 . . . . 0.0 110.024 -177.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.61 140.9 69.9 Favored 'Cis proline' 0 N--CA 1.497 1.719 0 CA-C-N 121.909 1.717 . . . . 0.0 111.738 -1.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -63.97 -41.37 97.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.986 -177.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.442 ' HB3' HD12 ' A' ' 80' ' ' ILE . 73.9 m80 -143.15 137.94 29.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.315 0.579 . . . . 0.0 110.911 -177.233 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.0 t -150.04 151.63 33.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.421 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 56.7 mt -115.08 139.81 39.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.961 -177.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -131.79 142.09 49.65 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.082 -178.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.1 mt -119.84 126.69 75.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.207 0.527 . . . . 0.0 109.771 171.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -94.66 99.56 11.65 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.648 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -73.28 105.96 4.91 Favored 'General case' 0 C--N 1.332 -0.16 0 O-C-N 123.687 0.617 . . . . 0.0 110.934 -175.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 25.9 mmt85 -74.36 -40.48 62.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.447 -170.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 45.0 mt -74.07 -45.16 51.05 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.77 0.319 . . . . 0.0 111.411 -175.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 29.8 t-20 -95.04 -3.2 48.7 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -175.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.5 p 50.95 43.22 28.83 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.496 0.665 . . . . 0.0 111.147 178.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 37.2 m -122.97 142.94 50.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.143 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.2 p -91.83 127.97 37.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.29 -178.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -117.46 122.15 42.96 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 175.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 p -125.56 146.96 30.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-O 120.705 0.288 . . . . 0.0 111.08 -178.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -149.83 126.48 5.3 Favored Pre-proline 0 CA--C 1.539 0.546 0 CA-C-O 118.557 -0.735 . . . . 0.0 110.345 175.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -75.36 150.86 37.22 Favored 'Trans proline' 0 N--CA 1.498 1.765 0 C-N-CA 121.388 1.392 . . . . 0.0 112.105 177.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.442 HD12 ' HB3' ' A' ' 63' ' ' HIS . 63.1 mt -90.67 135.95 25.28 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 CA-C-O 120.937 0.399 . . . . 0.0 110.376 179.091 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.9 p -132.12 154.71 49.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.667 177.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -93.79 35.82 4.0 Favored Glycine 0 CA--C 1.525 0.68 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.048 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 46.7 p -111.0 -21.08 12.18 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 111.995 0.368 . . . . 0.0 111.995 174.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.6 mt -68.43 147.19 52.42 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-O 120.909 0.385 . . . . 0.0 111.367 -175.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.9 tt0 -114.31 135.82 53.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.768 176.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 60.4 mt -115.6 157.58 23.93 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.959 0.409 . . . . 0.0 110.882 -176.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -149.22 142.39 25.01 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 178.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.1 t -99.03 109.14 21.93 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.613 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -106.8 103.73 48.36 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 172.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -70.55 142.99 45.8 Favored 'Trans proline' 0 N--CA 1.497 1.72 0 CA-C-N 120.546 1.231 . . . . 0.0 112.138 -170.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -90.62 14.27 50.96 Favored 'Cis proline' 0 N--CA 1.5 1.901 0 CA-C-N 121.049 1.41 . . . . 0.0 113.534 -4.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -94.89 170.42 9.44 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 122.378 0.271 . . . . 0.0 110.758 -177.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 54.1 tp -116.1 133.2 56.28 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 173.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.8 tp -124.67 139.98 53.36 Favored 'General case' 0 C--N 1.334 -0.101 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 -173.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -144.5 153.09 41.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.972 0.415 . . . . 0.0 110.564 175.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.6 mtm180 -103.89 144.35 31.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.739 -177.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -127.57 163.05 25.02 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.893 0.854 . . . . 0.0 111.761 -176.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -47.84 149.24 1.35 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.14 -177.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 87.5 mtt-85 63.5 30.87 15.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.155 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 34.9 m 66.27 35.16 6.07 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.913 0.387 . . . . 0.0 111.628 165.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 40.3 mtp180 -99.87 147.32 25.65 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 82.9 mt -113.33 126.92 70.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -178.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -136.12 148.36 48.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.429 -178.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -144.73 169.3 26.62 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 120.771 -0.728 . . . . 0.0 111.651 -178.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -126.0 141.85 51.78 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.292 -0.454 . . . . 0.0 110.565 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 77.5 t90 -106.63 124.02 48.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.511 174.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.424 ' CD2' HG22 ' A' ' 31' ' ' VAL . 59.5 m-85 -109.65 140.19 43.78 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 123.312 0.383 . . . . 0.0 110.523 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -50.33 -37.13 35.15 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.845 178.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 39.1 t-20 -133.72 135.49 44.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.345 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.2 m -61.63 -42.77 99.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.056 -177.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -59.43 -43.64 93.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.373 0.606 . . . . 0.0 110.084 179.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -56.56 -43.7 80.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.133 178.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 51.4 t -59.31 -40.99 87.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.353 177.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -58.88 -44.57 91.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.8 0.333 . . . . 0.0 110.627 -177.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -59.99 -49.74 76.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.944 0.402 . . . . 0.0 110.649 -177.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.492 HG23 HD11 ' A' ' 54' ' ' ILE . 29.8 mm -58.46 -45.31 90.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.099 0.476 . . . . 0.0 110.067 -178.344 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 61.1 p -59.41 -43.03 93.1 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.73 -177.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.73 -43.99 94.3 Favored Glycine 0 CA--C 1.523 0.545 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 -178.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.478 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.8 mt -58.4 -48.21 81.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.074 0.464 . . . . 0.0 110.459 -178.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.442 ' HA ' HD12 ' A' ' 123' ' ' LEU . 55.4 t -59.0 -42.57 86.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.167 -179.225 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.467 ' HA ' HD12 ' A' ' 124' ' ' LEU . 26.6 m120 -57.38 -42.07 81.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.896 0.379 . . . . 0.0 110.605 -179.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -59.65 -44.63 96.72 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.442 HD12 ' HA ' ' A' ' 120' ' ' VAL . 58.0 mt -57.68 -42.99 84.74 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.98 0.419 . . . . 0.0 110.429 179.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.467 HD12 ' HA ' ' A' ' 121' ' ' ASN . 17.7 mt . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.548 179.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B 1338 ' ' LEU . . . . . 0.453 HD12 ' CB ' ' A' ' 43' ' ' TRP . 18.9 mt . . . . . 0 C--O 1.234 0.279 0 CA-C-O 118.461 -0.781 . . . . 0.0 109.488 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.21 139.65 15.04 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 CA-C-N 120.435 1.191 . . . . 0.0 111.083 174.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 19.8 mtmm -97.31 125.94 43.64 Favored Pre-proline 0 CA--C 1.535 0.401 0 CA-C-O 118.514 -0.755 . . . . 0.0 110.188 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -63.25 161.15 31.69 Favored 'Trans proline' 0 N--CA 1.498 1.759 0 CA-C-N 120.563 1.237 . . . . 0.0 111.553 176.045 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -49.19 157.04 2.07 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 121.38 1.386 . . . . 0.0 111.812 178.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B 1343 ' ' LEU . . . . . 0.531 ' H ' HD12 ' B' 1343 ' ' LEU . 6.2 mp -49.99 -25.58 3.47 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -176.492 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 68.8 t80 -55.95 -38.46 70.39 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.809 0.337 . . . . 0.0 111.084 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 50.5 t90 -60.88 -48.08 83.42 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.509 -176.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -63.61 -49.27 73.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.067 0.46 . . . . 0.0 110.785 -177.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -59.34 -43.86 92.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.926 -176.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -59.19 -48.32 82.04 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.638 -176.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.17 -49.12 78.87 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.733 -177.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 61.7 tt0 . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.226 -176.046 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.1 m . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.911 0.386 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 48.2 mm -59.81 -44.7 94.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.216 -178.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.0 m -59.58 -44.05 93.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.571 -177.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -59.92 -45.2 93.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.563 -178.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 87.8 mtp -58.26 -44.21 88.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.093 0.473 . . . . 0.0 110.458 -178.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -60.75 -49.18 78.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.296 -178.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.66 ' HA ' HD12 ' A' ' 14' ' ' ILE . 10.4 tp -59.75 -33.02 71.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.058 -178.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.34 -50.58 69.44 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.649 0.262 . . . . 0.0 110.851 179.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.96 -41.67 83.38 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.944 0.402 . . . . 0.0 110.404 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.677 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 93.9 mt -54.13 -52.98 32.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.724 178.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -51.93 -24.76 6.85 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -178.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 65.8 mmtt -59.24 -33.73 71.37 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -177.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.6 mm -109.77 -43.67 5.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.0 0.429 . . . . 0.0 110.071 -176.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -117.61 77.15 10.7 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.968 -178.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -55.2 -20.49 24.78 Favored 'Trans proline' 0 N--CA 1.497 1.731 0 C-N-CA 121.47 1.447 . . . . 0.0 113.531 -175.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.3 p90 -90.61 11.62 21.44 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -174.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -88.15 131.21 34.8 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 174.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.572 ' O ' HD21 ' A' ' 11' ' ' LEU . 99.1 mttt -108.31 -38.69 5.66 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.745 0.307 . . . . 0.0 111.145 -175.17 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -135.86 147.65 48.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.007 0.432 . . . . 0.0 111.183 -175.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.411 HD11 HD12 ' A' ' 14' ' ' ILE . 21.8 mt -99.39 134.28 39.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 171.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.6 t -92.83 -47.13 13.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.242 -0.435 . . . . 0.0 109.877 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.504 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.1 t0 -152.23 155.06 36.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.014 178.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.1 p -142.7 131.95 23.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.171 0.51 . . . . 0.0 110.895 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.6 t -107.27 126.58 52.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.695 177.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.7 t -54.38 -38.67 66.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.154 -172.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 -150.7 127.21 10.78 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.294 0.569 . . . . 0.0 111.689 -179.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.439 HG21 ' HB3' ' A' ' 52' ' ' PHE . 92.8 t -144.84 138.55 22.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.336 -178.094 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.59 149.81 50.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.303 -177.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -99.68 131.2 45.82 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.259 0.552 . . . . 0.0 111.833 -176.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -123.85 141.75 51.75 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.466 178.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 72.5 m -120.99 147.01 46.08 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -107.79 131.9 53.97 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.951 0.405 . . . . 0.0 110.416 175.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.6 t-20 -104.31 115.65 30.76 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.977 178.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 27.1 t -67.65 -33.12 74.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.9 -177.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.1 m -60.56 -39.79 89.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.752 0.31 . . . . 0.0 110.887 -177.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -93.13 -21.52 19.63 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 19.2 t30 69.13 42.69 1.2 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-O 121.288 0.566 . . . . 0.0 109.809 -177.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.0 mt-10 -151.34 164.17 37.29 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.156 -177.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.428 ' CB ' HD12 ' B' 1338 ' ' LEU . 83.9 m95 -94.12 141.66 28.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.352 177.537 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.9 tp10 -124.97 127.53 47.17 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 177.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.7 ttpp -73.64 139.15 45.25 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 177.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 52.4 p -92.23 172.23 8.55 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.071 -178.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -84.08 12.6 6.13 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 178.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.7 t -104.05 106.43 20.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-O 121.068 0.461 . . . . 0.0 110.346 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -132.22 114.43 14.45 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 176.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.59 176.51 38.91 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.022 -1.085 . . . . 0.0 112.3 -169.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.484 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -81.31 135.81 35.73 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 175.415 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.439 ' HB3' HG21 ' A' ' 31' ' ' VAL . 6.2 t80 -99.42 127.34 45.46 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.883 -0.327 . . . . 0.0 110.126 -176.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.484 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 7.4 m-85 -131.67 142.46 49.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.723 0.297 . . . . 0.0 110.339 177.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.673 HD11 HG23 ' A' ' 116' ' ' ILE . 68.6 mt -101.61 127.95 54.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 171.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.677 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.3 m-30 -108.53 135.55 49.61 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.855 0.36 . . . . 0.0 111.302 -175.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 68.8 t60 -109.71 143.28 39.72 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.104 174.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 60.5 ttt180 -141.92 146.75 36.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.233 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -86.88 28.11 0.93 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.112 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.7 166.16 33.53 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -63.99 127.64 92.03 Favored Pre-proline 0 CA--C 1.539 0.537 0 CA-C-O 118.445 -0.788 . . . . 0.0 110.066 -177.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -75.98 140.94 68.94 Favored 'Cis proline' 0 N--CA 1.497 1.702 0 CA-C-N 121.89 1.711 . . . . 0.0 111.765 -1.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -62.45 -42.26 99.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.945 -178.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.4 ' HB3' HD12 ' A' ' 80' ' ' ILE . 73.3 m80 -142.84 138.58 30.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.436 0.636 . . . . 0.0 110.891 -177.131 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.8 t -150.19 151.73 33.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.311 -178.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 47.7 mt -110.31 139.81 32.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -131.78 142.03 49.64 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.761 -176.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 59.7 mt -124.62 128.99 73.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.249 0.547 . . . . 0.0 110.06 173.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -96.26 99.54 11.24 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.53 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.2 t-20 -74.7 106.29 6.19 Favored 'General case' 0 C--N 1.331 -0.209 0 O-C-N 123.647 0.592 . . . . 0.0 110.933 -175.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 71.2 mtm180 -73.16 -43.91 60.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.588 -170.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 29.8 mt -72.56 -45.09 60.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.634 -174.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 37.2 t-20 -95.13 -3.11 48.57 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -174.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 73.0 p 50.73 42.9 28.0 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.478 0.656 . . . . 0.0 111.186 177.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.0 m -125.43 133.87 52.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.275 -179.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 80.4 p -80.16 130.45 35.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.301 -178.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -118.46 122.22 42.19 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 174.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 34.6 t -125.48 145.62 32.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-O 120.725 0.298 . . . . 0.0 110.674 -177.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -148.26 126.41 5.93 Favored Pre-proline 0 CA--C 1.538 0.492 0 CA-C-O 118.64 -0.695 . . . . 0.0 110.496 174.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -75.42 150.9 37.02 Favored 'Trans proline' 0 N--CA 1.5 1.875 0 C-N-CA 121.462 1.442 . . . . 0.0 112.184 177.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.4 HD12 ' HB3' ' A' ' 63' ' ' HIS . 66.5 mt -92.15 133.09 34.69 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.31 178.257 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.6 p -132.21 159.54 38.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.732 177.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -94.54 36.69 3.67 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.96 -178.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 51.7 p -111.07 -22.49 11.44 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 174.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.84 145.04 54.07 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-O 120.878 0.37 . . . . 0.0 111.251 -176.062 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 57.5 tt0 -116.93 135.78 53.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.729 175.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 63.2 mt -113.28 159.19 19.62 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.702 -176.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -150.02 143.94 25.49 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 178.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 29.3 t -99.59 109.15 21.68 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.462 -0.495 . . . . 0.0 110.326 178.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.404 ' HG3' HD22 ' A' ' 94' ' ' LEU . 19.3 mm-40 -106.83 103.75 48.55 Favored Pre-proline 0 C--N 1.329 -0.317 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 172.638 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -67.38 142.37 59.68 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 CA-C-N 120.491 1.211 . . . . 0.0 111.787 -172.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -90.76 12.73 55.38 Favored 'Cis proline' 0 N--CA 1.5 1.899 0 CA-C-N 121.146 1.445 . . . . 0.0 113.493 -4.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -94.9 170.17 9.62 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 122.304 0.242 . . . . 0.0 110.618 -176.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 58.0 tp -111.99 134.91 53.25 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 171.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.441 HD21 ' HZ2' ' B' 1345 ' ' TRP . 10.6 tp -126.88 139.65 52.92 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.5 0.191 . . . . 0.0 110.606 -173.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 50.9 p90 -145.5 156.81 43.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.798 0.332 . . . . 0.0 110.534 175.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.8 mtm105 -102.07 146.89 27.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.66 -178.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -126.47 163.81 22.52 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.591 0.71 . . . . 0.0 111.374 -177.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -47.16 144.86 2.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.192 -177.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 31.9 ttt85 65.27 30.92 11.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.416 -0.811 . . . . 0.0 112.021 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.5 p 65.59 35.24 7.22 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.871 0.367 . . . . 0.0 111.719 166.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 91.7 mtt-85 -98.0 152.74 18.95 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.363 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 78.3 mt -114.58 127.58 72.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -177.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -137.56 150.32 47.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.675 178.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.06 169.3 25.03 Favored Glycine 0 CA--C 1.522 0.53 0 N-CA-C 111.346 -0.702 . . . . 0.0 111.346 -176.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -125.3 139.78 53.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.902 0.382 . . . . 0.0 110.894 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 66.5 t90 -107.1 121.57 44.75 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.574 174.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.439 ' CD1' HG22 ' A' ' 31' ' ' VAL . 61.2 m-85 -111.74 140.19 46.58 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.131 0.269 . . . . 0.0 110.461 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -49.93 -37.72 33.03 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.793 178.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 46.3 t-20 -134.76 131.43 37.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.107 178.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.4 p -57.14 -38.24 73.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.884 -179.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -57.81 -44.84 86.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.524 0.678 . . . . 0.0 109.962 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -57.28 -45.28 84.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.026 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 47.5 t -59.3 -39.59 83.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.612 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -60.07 -46.26 90.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.908 0.385 . . . . 0.0 110.705 -177.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -59.96 -48.96 79.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.652 -177.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.673 HG23 HD11 ' A' ' 54' ' ' ILE . 31.7 mm -58.62 -44.74 90.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.037 -178.581 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 57.6 p -59.46 -43.82 93.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.739 -177.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.78 -44.74 94.08 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.687 -0.965 . . . . 0.0 110.687 -178.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.504 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.1 mt -58.32 -47.64 83.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.115 0.483 . . . . 0.0 110.501 -178.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 51.7 t -59.15 -43.41 89.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.137 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -57.25 -41.95 80.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.907 0.384 . . . . 0.0 110.673 -178.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.55 -46.27 94.64 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 -179.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 72.4 mt -58.55 -42.62 88.29 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.943 0.401 . . . . 0.0 110.662 -179.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 48.1 mt . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.82 -179.086 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B 1338 ' ' LEU . . . . . 0.428 HD12 ' CB ' ' A' ' 43' ' ' TRP . 13.5 mt . . . . . 0 CA--C 1.531 0.219 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -79.11 139.86 15.35 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 C-N-CA 121.229 1.286 . . . . 0.0 111.339 175.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 27.5 mmtp -97.13 125.76 44.69 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 118.889 -0.577 . . . . 0.0 110.225 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -74.09 155.72 47.33 Favored 'Trans proline' 0 N--CA 1.495 1.613 0 C-N-CA 121.429 1.419 . . . . 0.0 111.704 172.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -51.73 154.76 8.91 Favored 'Trans proline' 0 N--CA 1.494 1.554 0 C-N-CA 121.361 1.374 . . . . 0.0 111.783 178.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 26.0 tp -49.91 -29.17 7.76 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -177.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 64.7 t80 -54.93 -37.12 66.0 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.898 0.38 . . . . 0.0 111.228 -176.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B 1345 ' ' TRP . . . . . 0.441 ' HZ2' HD21 ' A' ' 94' ' ' LEU . 34.2 t90 -60.55 -48.14 83.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.261 -177.006 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -62.58 -48.8 77.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.119 0.485 . . . . 0.0 110.57 -177.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -59.2 -42.62 91.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.938 -176.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -59.12 -48.52 81.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.861 0.362 . . . . 0.0 110.594 -176.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.63 -48.94 79.71 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.601 -177.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.7 tt0 . . . . . 0 C--N 1.326 -0.431 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.174 -176.505 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.5 m . . . . . 0 CA--C 1.527 0.081 0 CA-C-O 120.899 0.38 . . . . 0.0 110.768 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mm -60.29 -47.08 93.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.991 0.424 . . . . 0.0 110.051 -178.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 35.3 m -58.98 -44.62 91.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.448 -177.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -59.22 -45.0 92.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.608 -178.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 44.1 ttm -58.34 -44.01 88.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.025 0.44 . . . . 0.0 110.319 -178.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 29.7 m120 -60.13 -49.62 76.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.271 -178.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.698 ' HA ' HD12 ' A' ' 14' ' ' ILE . 10.8 tp -59.62 -33.25 71.27 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.066 -178.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.04 -50.35 70.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.632 0.254 . . . . 0.0 110.798 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.04 -41.77 83.97 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.018 0.437 . . . . 0.0 110.455 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.698 HD12 ' HA ' ' A' ' 11' ' ' LEU . 94.9 mt -54.16 -52.96 32.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.66 178.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -52.51 -23.69 6.7 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -178.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.1 tttm -59.0 -33.65 70.95 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 -177.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.9 mm -109.89 -42.9 5.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.942 0.401 . . . . 0.0 110.204 -177.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -116.85 80.07 10.66 Favored Pre-proline 0 CA--C 1.535 0.375 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.341 -176.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -54.2 -22.59 26.43 Favored 'Trans proline' 0 N--CA 1.498 1.741 0 C-N-CA 121.533 1.489 . . . . 0.0 113.379 -176.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -92.1 14.42 16.04 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 -174.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -91.78 121.46 33.43 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 173.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.622 ' O ' HD21 ' A' ' 11' ' ' LEU . 22.9 tptm -104.37 -39.83 6.31 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.135 -172.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -134.31 147.72 50.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.099 -176.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.415 HD11 HD12 ' A' ' 14' ' ' ILE . 22.6 mt -99.6 133.25 43.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 172.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.8 t -92.48 -47.25 14.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.983 179.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.5 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.0 t0 -153.07 151.15 29.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.84 178.331 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.1 p -139.02 132.04 29.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.059 0.457 . . . . 0.0 110.925 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.6 t -106.28 125.83 51.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.63 176.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.7 m -54.04 -37.85 64.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.241 -173.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 64.6 t-80 -151.52 126.94 10.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.331 0.586 . . . . 0.0 111.737 -179.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.41 HG21 ' HB3' ' A' ' 52' ' ' PHE . 94.8 t -144.97 140.83 23.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.399 -178.128 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.48 149.92 51.05 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.211 -177.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -98.32 131.96 44.19 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.35 0.595 . . . . 0.0 111.889 -176.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -124.58 143.18 50.84 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.6 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 86.1 m -121.94 144.76 48.68 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -106.5 131.96 53.07 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.881 0.372 . . . . 0.0 110.116 175.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 -103.62 115.05 29.79 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.828 177.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.7 t -67.93 -32.56 73.1 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.958 -176.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.4 m -60.29 -39.06 85.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.663 0.268 . . . . 0.0 110.996 -177.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -95.82 -21.46 18.09 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 69.71 44.37 0.87 Allowed 'General case' 0 C--O 1.232 0.181 0 CA-C-O 121.402 0.62 . . . . 0.0 109.697 -178.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -150.4 162.68 40.09 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.143 -177.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.413 ' CB ' HD12 ' B' 1338 ' ' LEU . 85.3 m95 -94.94 140.08 30.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.403 178.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -122.26 130.33 53.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.076 177.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.9 pttp -75.43 139.27 42.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.293 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.7 p -92.33 169.4 10.61 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.651 -0.419 . . . . 0.0 109.95 178.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.1 p30 -85.79 13.11 7.73 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 177.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 40.2 t -104.11 106.44 20.32 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-O 121.025 0.441 . . . . 0.0 110.313 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -130.76 114.59 15.54 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 176.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -161.94 176.47 38.38 Favored Glycine 0 CA--C 1.519 0.338 0 C-N-CA 120.099 -1.048 . . . . 0.0 112.451 -169.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.517 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -79.71 136.28 36.74 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 175.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.41 ' HB3' HG21 ' A' ' 31' ' ' VAL . 4.8 t80 -101.44 123.5 45.6 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 120.952 -0.299 . . . . 0.0 110.23 -176.34 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.517 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 5.0 m-85 -128.25 141.16 51.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.629 0.252 . . . . 0.0 110.658 177.057 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.425 HD11 HG23 ' A' ' 116' ' ' ILE . 74.6 mt -101.5 127.06 55.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 171.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.627 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 12.3 m-30 -108.55 138.94 44.03 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.956 0.408 . . . . 0.0 111.346 -177.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 61.5 t60 -108.81 143.38 38.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.912 174.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 64.3 ttt180 -140.47 145.85 37.46 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.025 177.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.9 m120 -86.97 28.18 0.94 Allowed 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.268 -0.423 . . . . 0.0 112.045 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.31 166.09 33.17 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 179.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -64.05 127.91 92.4 Favored Pre-proline 0 CA--C 1.54 0.574 0 CA-C-O 118.463 -0.779 . . . . 0.0 109.949 -177.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -75.66 140.98 69.52 Favored 'Cis proline' 0 N--CA 1.497 1.702 0 CA-C-N 121.835 1.691 . . . . 0.0 111.741 -1.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -62.73 -41.87 99.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.955 -177.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.403 ' HB3' HD12 ' A' ' 80' ' ' ILE . 73.5 m80 -143.25 139.55 30.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.359 0.6 . . . . 0.0 110.908 -177.079 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.4 t -149.99 151.76 33.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.345 -178.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 51.7 mt -114.68 138.92 43.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 -177.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -131.82 142.16 49.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.391 -178.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.5 mt -121.07 129.63 75.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.248 0.547 . . . . 0.0 109.738 172.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -97.21 99.54 11.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.492 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -73.31 106.06 4.97 Favored 'General case' 0 C--N 1.332 -0.188 0 O-C-N 123.702 0.626 . . . . 0.0 111.013 -175.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.2 ttm180 -72.85 -43.39 62.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.416 -171.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 52.6 mt -70.3 -45.25 66.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.605 -174.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 39.0 m-20 -95.1 -3.17 48.57 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -175.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 67.4 p 51.63 43.15 30.01 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.55 0.69 . . . . 0.0 110.996 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.1 m -124.85 142.02 51.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.277 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.3 p -88.58 133.66 34.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.389 -178.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -123.69 122.09 37.19 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 175.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.8 p -125.57 147.34 30.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 120.836 0.35 . . . . 0.0 111.109 -178.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -149.8 126.49 5.31 Favored Pre-proline 0 CA--C 1.539 0.534 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.203 175.214 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -75.39 150.91 37.17 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 121.371 1.38 . . . . 0.0 112.067 178.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.403 HD12 ' HB3' ' A' ' 63' ' ' HIS . 64.9 mt -89.78 115.81 30.03 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.328 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 66.0 p -97.92 159.01 15.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.94 176.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -95.4 24.96 26.79 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.817 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.3 p -111.07 -10.9 14.33 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 175.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.0 mt -67.96 135.16 51.94 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.856 0.36 . . . . 0.0 111.423 -175.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -111.05 135.92 50.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.768 175.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 66.6 mt -113.91 161.15 17.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.998 0.428 . . . . 0.0 111.056 -175.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -150.04 140.93 22.82 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 177.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.2 t -102.27 109.2 20.81 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.582 -0.447 . . . . 0.0 111.046 -178.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -106.82 103.75 48.52 Favored Pre-proline 0 C--N 1.329 -0.301 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 170.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -69.56 141.85 47.16 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 CA-C-N 120.654 1.269 . . . . 0.0 111.811 -172.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -90.08 11.94 57.5 Favored 'Cis proline' 0 N--CA 1.499 1.816 0 CA-C-N 121.068 1.417 . . . . 0.0 113.628 -3.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -90.86 169.54 10.84 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.686 0.279 . . . . 0.0 110.765 -178.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 50.7 tp -118.77 134.66 54.98 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 171.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.434 HD11 ' CG2' ' A' ' 102' ' ' ILE . 9.3 tp -125.58 140.37 52.79 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.637 0.256 . . . . 0.0 110.426 -175.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 22.2 p90 -145.42 155.09 42.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.787 0.327 . . . . 0.0 110.239 175.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.1 mtm105 -101.98 147.75 26.18 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.877 0.37 . . . . 0.0 110.624 -177.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -128.85 165.65 20.58 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.731 0.777 . . . . 0.0 111.523 -176.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -47.11 146.93 1.6 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.553 -0.748 . . . . 0.0 112.285 -177.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 63.33 30.92 15.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.227 179.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.5 p 66.26 35.25 6.05 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.729 0.3 . . . . 0.0 111.685 166.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -98.87 152.78 19.37 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.434 ' CG2' HD11 ' A' ' 94' ' ' LEU . 86.5 mt -115.46 126.96 73.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -178.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -133.92 150.24 51.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.58 178.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.6 167.38 25.89 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 111.351 -0.7 . . . . 0.0 111.351 -176.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -125.38 139.53 53.59 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.517 -0.341 . . . . 0.0 110.663 -179.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 7.6 t90 -107.16 125.72 51.46 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.417 174.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -113.52 141.8 46.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.792 0.329 . . . . 0.0 110.625 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -51.43 -35.32 38.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.691 178.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.2 t-20 -137.38 136.75 38.17 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.755 0.312 . . . . 0.0 110.403 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 25.1 m -61.38 -42.56 98.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.107 -177.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -57.84 -43.2 85.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.368 0.604 . . . . 0.0 110.106 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -57.03 -45.9 82.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.869 178.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 43.0 t -59.6 -37.74 79.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.889 178.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -61.73 -50.08 73.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.656 0.265 . . . . 0.0 110.856 -175.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -61.65 -44.75 96.38 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.987 -176.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.496 ' HA ' HD12 ' A' ' 119' ' ' LEU . 23.1 mm -59.52 -46.86 92.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 19.3 m -58.55 -44.62 89.71 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.563 -177.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.39 -43.33 93.91 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 -178.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.5 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.7 mt -58.25 -49.45 77.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.143 0.497 . . . . 0.0 110.489 -178.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 54.5 t -58.8 -43.87 89.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.171 -177.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -59.05 -42.3 89.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.825 -178.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.94 -41.94 99.7 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 111.407 -0.677 . . . . 0.0 111.407 -178.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 20.8 mt -63.67 -43.54 96.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.788 0.328 . . . . 0.0 111.181 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 66.9 mt . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.437 -176.483 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B 1338 ' ' LEU . . . . . 0.413 HD12 ' CB ' ' A' ' 43' ' ' TRP . 16.1 mt . . . . . 0 C--O 1.234 0.259 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -79.14 139.82 15.26 Favored 'Trans proline' 0 N--CA 1.491 1.351 0 C-N-CA 121.166 1.244 . . . . 0.0 111.215 174.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -97.2 125.78 44.46 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-O 118.796 -0.621 . . . . 0.0 109.861 178.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -75.09 163.43 35.15 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 121.425 1.417 . . . . 0.0 111.694 173.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.56 157.2 32.9 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 121.341 1.36 . . . . 0.0 111.341 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 26.4 tp -50.06 -27.61 5.85 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -176.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -54.61 -36.7 64.74 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.867 0.365 . . . . 0.0 111.294 -177.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 39.2 t90 -61.08 -48.13 83.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.247 -177.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -61.2 -46.35 90.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.051 0.453 . . . . 0.0 110.477 -178.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -59.35 -44.71 92.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.722 -177.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -58.28 -46.33 86.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.451 -176.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.07 -47.74 84.6 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.631 -178.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.2 tt0 . . . . . 0 C--N 1.326 -0.414 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.951 -177.123 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.5 p . . . . . 0 CA--C 1.527 0.084 0 CA-C-O 120.756 0.312 . . . . 0.0 110.941 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 43.7 mm -62.29 -40.78 89.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.372 179.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.9 m -63.49 -49.97 71.47 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.679 -176.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.7 ptt180 -61.88 -37.45 84.61 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.799 -178.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 44.0 ttm -58.68 -46.21 87.72 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.151 0.5 . . . . 0.0 110.143 179.252 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -59.67 -48.92 79.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.195 -178.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.687 ' HA ' HD12 ' A' ' 14' ' ' ILE . 9.3 tp -59.74 -32.97 71.06 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.651 -0.419 . . . . 0.0 111.177 -178.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.84 -50.53 70.59 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.654 0.264 . . . . 0.0 110.701 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.64 -41.74 86.7 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.43 179.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.687 HD12 ' HA ' ' A' ' 11' ' ' LEU . 95.3 mt -54.19 -52.94 33.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.649 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -54.15 -21.6 9.17 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -178.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -58.64 -33.96 70.66 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 111.727 0.269 . . . . 0.0 111.727 -178.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.699 HG21 ' CB ' ' A' ' 75' ' ' SER . 46.6 mm -113.0 -40.15 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-O 120.722 0.296 . . . . 0.0 110.531 -177.015 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -117.05 77.38 8.99 Favored Pre-proline 0 CA--C 1.535 0.368 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.214 -178.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -55.39 -20.71 26.86 Favored 'Trans proline' 0 N--CA 1.498 1.76 0 C-N-CA 121.536 1.49 . . . . 0.0 113.459 -175.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.8 p90 -90.77 9.94 28.04 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -174.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -84.62 122.32 28.88 Favored 'General case' 0 C--O 1.231 0.11 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 174.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.409 ' O ' HD21 ' A' ' 11' ' ' LEU . 31.4 ttpt -97.49 -40.54 8.61 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.887 -173.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -148.44 153.06 38.0 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.586 -0.445 . . . . 0.0 111.433 -178.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 29.9 mt -94.38 138.3 20.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.848 178.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.2 t -92.58 -47.17 14.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.839 177.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.502 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.9 t0 -152.88 155.06 36.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.019 178.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.8 p -141.86 132.02 24.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.044 0.449 . . . . 0.0 110.943 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.5 t -108.49 126.45 52.93 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.647 177.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.4 t -54.58 -38.85 67.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.28 -172.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -150.45 126.8 10.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.225 0.536 . . . . 0.0 111.558 -179.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.456 HG22 ' CD2' ' A' ' 107' ' ' PHE . 96.2 t -145.19 140.43 22.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.309 -177.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.64 149.76 51.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.725 0.298 . . . . 0.0 111.314 -177.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.511 ' HD2' HG21 ' A' ' 46' ' ' THR . 36.4 t80 -98.63 130.83 45.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.27 -177.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -125.31 142.08 51.71 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.599 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.579 HG23 ' CZ ' ' A' ' 103' ' ' ARG . 64.1 m -120.38 145.86 46.75 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 178.342 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -108.27 131.87 54.26 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 121.011 0.434 . . . . 0.0 110.433 176.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -104.11 115.45 30.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.888 177.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.0 t -67.63 -32.51 73.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.918 -177.307 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.1 t -60.44 -40.26 90.44 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.726 0.298 . . . . 0.0 110.82 -177.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 98.0 mm-40 -93.8 -21.36 19.34 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 69.66 43.48 0.98 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-O 121.436 0.636 . . . . 0.0 109.803 -177.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -151.51 162.97 40.05 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.037 -177.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.456 ' CB ' HD12 ' B' 1338 ' ' LEU . 89.0 m95 -94.33 141.76 28.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.336 177.507 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -124.01 130.42 52.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 0.0 109.958 176.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -72.42 139.21 47.65 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 177.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.511 HG21 ' HD2' ' A' ' 33' ' ' PHE . 77.3 p -92.35 179.04 5.66 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.298 -178.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -88.67 15.17 8.57 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -179.081 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.4 t -111.88 106.42 20.73 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 CA-C-O 120.982 0.42 . . . . 0.0 110.273 178.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -132.19 112.93 12.7 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 174.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.52 38.96 Favored Glycine 0 CA--C 1.52 0.4 0 C-N-CA 120.202 -0.999 . . . . 0.0 112.213 -168.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.478 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.47 135.95 37.49 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 174.647 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.419 ' HB3' HG21 ' A' ' 31' ' ' VAL . 6.3 t80 -101.26 127.04 48.03 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.346 -175.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.478 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 6.5 m-85 -130.76 142.09 50.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.765 0.316 . . . . 0.0 110.308 177.143 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.699 HD11 HG23 ' A' ' 116' ' ' ILE . 66.3 mt -101.62 127.58 54.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 172.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.672 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.2 m-30 -108.48 137.62 46.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.997 0.427 . . . . 0.0 111.208 -175.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 30.1 t60 -116.7 143.31 45.79 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.967 175.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -141.22 147.43 38.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.141 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -86.9 28.1 0.93 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.275 -0.421 . . . . 0.0 112.125 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.72 160.5 37.97 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 178.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -64.05 131.78 95.08 Favored Pre-proline 0 CA--C 1.539 0.547 0 CA-C-O 118.536 -0.745 . . . . 0.0 110.04 -176.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -71.13 140.88 67.16 Favored 'Cis proline' 0 N--CA 1.498 1.792 0 CA-C-N 121.701 1.643 . . . . 0.0 111.515 -1.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -65.22 -42.73 93.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.028 -177.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -143.52 140.97 30.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.494 0.664 . . . . 0.0 111.038 -177.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.3 t -150.42 152.39 34.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.211 -178.024 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 46.5 mt -112.58 138.13 42.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -178.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 79.2 t80 -131.83 142.02 49.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.972 -176.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.0 mt -123.62 133.23 69.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.18 0.514 . . . . 0.0 109.847 172.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -99.16 99.55 10.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.37 179.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -72.42 106.95 4.74 Favored 'General case' 0 C--N 1.332 -0.193 0 O-C-N 123.666 0.604 . . . . 0.0 111.092 -175.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 55.6 ttp180 -72.86 -41.04 65.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.198 -171.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 75.5 mt -70.51 -45.16 66.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.684 -175.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -95.01 -3.34 48.57 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -175.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.43 HG22 ' O ' ' A' ' 73' ' ' THR . 13.0 m 55.87 43.1 28.11 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 121.452 0.644 . . . . 0.0 110.57 177.064 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.6 m -131.78 149.03 52.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.229 -178.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.699 ' CB ' HG21 ' A' ' 17' ' ' ILE . 4.0 p -101.71 141.82 33.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.929 0.395 . . . . 0.0 110.933 -179.087 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -135.45 122.13 20.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.231 178.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.8 p -125.49 148.53 30.02 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-O 120.807 0.337 . . . . 0.0 111.035 -177.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -147.17 136.27 11.48 Favored Pre-proline 0 CA--C 1.537 0.456 0 CA-C-O 119.03 -0.509 . . . . 0.0 110.487 174.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.51 150.87 36.61 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 121.673 1.582 . . . . 0.0 112.411 179.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 68.8 mt -89.96 137.25 21.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.902 0.382 . . . . 0.0 110.165 177.118 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 61.6 p -132.15 159.47 38.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.866 177.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -95.79 36.04 4.03 Favored Glycine 0 CA--C 1.524 0.653 0 C-N-CA 120.845 -0.693 . . . . 0.0 111.914 -178.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.2 t -109.22 -21.97 12.31 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 174.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 74.8 mt -68.49 144.93 54.47 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-O 120.949 0.404 . . . . 0.0 111.492 -176.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 54.2 tt0 -114.78 135.87 53.71 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.715 175.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 67.6 mt -115.16 158.09 22.72 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.057 0.456 . . . . 0.0 111.11 -175.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -149.54 141.02 23.34 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 177.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.4 t -98.13 109.09 21.9 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.399 -0.521 . . . . 0.0 110.578 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -106.83 103.68 48.22 Favored Pre-proline 0 C--N 1.328 -0.355 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 172.118 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -71.41 142.22 40.41 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 CA-C-N 120.596 1.249 . . . . 0.0 112.025 -171.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -90.56 13.72 52.58 Favored 'Cis proline' 0 N--CA 1.499 1.844 0 CA-C-N 121.075 1.42 . . . . 0.0 113.541 -3.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -93.04 172.98 7.97 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 122.149 0.179 . . . . 0.0 110.721 -177.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 58.7 tp -115.94 135.7 53.73 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 171.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.2 tp -127.15 139.63 52.83 Favored 'General case' 0 C--N 1.334 -0.096 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 -174.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 9.4 p90 -148.84 153.79 38.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.951 0.405 . . . . 0.0 110.659 176.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 31.6 mtm180 -102.43 149.21 24.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.81 -176.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -129.73 166.53 19.68 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.791 0.805 . . . . 0.0 111.464 -177.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -47.77 145.01 3.01 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.249 -176.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 65.24 31.01 11.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.093 179.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 37.8 t 66.29 35.14 6.06 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.912 0.387 . . . . 0.0 111.578 166.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -98.25 152.77 19.06 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 179.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 78.0 mt -115.77 126.28 73.24 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 CA-C-O 121.061 0.458 . . . . 0.0 109.993 -177.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . 0.579 ' CZ ' HG23 ' A' ' 35' ' ' THR . 85.7 mmt-85 -127.95 149.4 50.35 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.276 178.123 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -140.54 164.69 26.27 Favored Glycine 0 CA--C 1.522 0.517 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 -178.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 32.9 m-85 -125.35 136.65 53.67 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.442 -0.379 . . . . 0.0 110.856 -178.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -107.41 126.35 52.38 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.735 175.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.456 ' CD2' HG22 ' A' ' 31' ' ' VAL . 62.8 m-85 -117.84 142.67 47.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.799 0.333 . . . . 0.0 110.51 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -51.15 -34.72 32.37 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.769 178.252 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -137.62 136.92 37.96 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.767 0.318 . . . . 0.0 110.469 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.0 p -61.69 -40.48 95.15 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.161 -177.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -59.72 -43.67 94.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.407 0.622 . . . . 0.0 110.095 178.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -56.73 -45.32 82.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.979 179.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 43.0 t -60.22 -39.69 87.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.728 178.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -59.21 -45.65 90.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.77 0.319 . . . . 0.0 110.562 -176.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -60.62 -49.04 79.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.744 -177.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.699 HG23 HD11 ' A' ' 54' ' ' ILE . 31.6 mm -58.46 -44.98 90.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.039 -178.374 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 68.1 p -59.74 -44.37 93.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.767 -177.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.7 -43.79 94.32 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 110.678 -0.969 . . . . 0.0 110.678 -178.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.502 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.2 mt -59.06 -48.72 80.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.034 0.445 . . . . 0.0 110.506 -178.323 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.403 HG12 HD11 ' A' ' 124' ' ' LEU . 53.3 t -58.82 -43.24 87.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.168 -178.502 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -57.97 -43.0 86.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.681 -178.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.5 -42.77 99.67 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.407 -0.677 . . . . 0.0 111.407 -178.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 34.4 mt -63.94 -40.74 97.14 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.765 0.317 . . . . 0.0 111.403 -179.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.403 HD11 HG12 ' A' ' 120' ' ' VAL . 29.8 mt . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.687 -176.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1338 ' ' LEU . . . . . 0.456 HD12 ' CB ' ' A' ' 43' ' ' TRP . 15.4 mt . . . . . 0 C--O 1.233 0.228 0 CA-C-O 119.406 -0.331 . . . . 0.0 110.123 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.05 139.96 15.51 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 C-N-CA 121.154 1.236 . . . . 0.0 111.145 174.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -97.12 125.83 44.47 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-O 118.782 -0.628 . . . . 0.0 109.97 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -77.79 154.9 30.57 Favored 'Trans proline' 0 N--CA 1.494 1.52 0 C-N-CA 121.415 1.41 . . . . 0.0 111.438 173.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -50.54 151.18 10.64 Favored 'Trans proline' 0 N--CA 1.496 1.647 0 C-N-CA 121.263 1.309 . . . . 0.0 111.747 178.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 79.5 mt -49.94 -25.83 3.62 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 -177.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -55.54 -38.49 69.35 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.904 0.383 . . . . 0.0 111.059 -177.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 33.3 t90 -61.81 -48.11 82.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.269 -176.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 37.6 tt0 -61.37 -48.2 82.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.073 0.463 . . . . 0.0 110.532 -177.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -59.86 -45.32 92.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 -177.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -58.76 -46.45 87.44 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.669 -176.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.53 -48.43 81.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.765 -177.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.104 -176.53 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.8 t . . . . . 0 N--CA 1.46 0.073 0 CA-C-O 120.892 0.377 . . . . 0.0 110.659 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.0 mm -60.09 -45.71 95.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.215 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.2 m -59.24 -45.66 90.57 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.024 0.44 . . . . 0.0 110.509 -177.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -59.38 -44.57 92.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.574 -178.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 44.5 ttm -58.26 -43.53 87.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.102 0.477 . . . . 0.0 110.463 -178.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -60.06 -49.5 77.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.299 -178.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.751 ' HA ' HD12 ' A' ' 14' ' ' ILE . 13.7 tp -61.32 -30.86 70.76 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.394 -179.144 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.85 -50.17 71.99 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.745 0.307 . . . . 0.0 110.619 178.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.44 -41.49 85.24 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.945 0.402 . . . . 0.0 110.392 178.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.751 HD12 ' HA ' ' A' ' 11' ' ' LEU . 95.5 mt -54.22 -52.95 33.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.659 178.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -53.3 -24.29 11.29 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -178.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -59.87 -33.52 71.93 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -177.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.5 mm -108.34 -40.69 4.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.787 0.327 . . . . 0.0 110.532 -176.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -114.78 84.94 10.89 Favored Pre-proline 0 CA--C 1.533 0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.713 -176.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -53.51 -22.97 23.33 Favored 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 121.522 1.482 . . . . 0.0 113.194 -178.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.4 p90 -97.98 22.06 9.84 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -175.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -101.81 121.23 41.7 Favored 'General case' 0 C--O 1.231 0.105 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 171.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.483 ' O ' HD21 ' A' ' 11' ' ' LEU . 51.1 tptt -110.95 -38.15 5.18 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.761 0.315 . . . . 0.0 111.272 -173.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -130.02 144.82 51.54 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.808 -176.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.471 HG13 HD13 ' A' ' 11' ' ' LEU . 59.4 mt -98.7 129.21 49.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.83 173.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.1 t -90.46 -47.11 14.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 0.0 109.914 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.494 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -153.37 152.13 30.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.129 178.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.7 p -140.82 131.96 26.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.992 0.425 . . . . 0.0 110.775 178.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.9 t -107.02 129.18 54.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.901 177.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.3 m -54.41 -38.3 66.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.269 -172.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 -152.41 127.53 9.77 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.323 0.583 . . . . 0.0 111.91 -178.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.469 HG22 ' CD2' ' A' ' 107' ' ' PHE . 98.4 t -145.2 140.69 22.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.466 -178.089 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.41 149.83 50.38 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.159 -178.079 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -97.03 132.78 42.49 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.204 0.526 . . . . 0.0 111.723 -177.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -128.16 142.85 51.06 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.668 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.3 m -121.5 148.09 44.92 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 177.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -112.48 131.69 55.45 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-O 120.865 0.364 . . . . 0.0 110.357 177.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -102.01 113.78 27.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.775 176.332 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 85.6 p -68.56 -31.02 69.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.074 -177.018 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.2 m -62.6 -38.58 90.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.667 0.27 . . . . 0.0 110.928 -177.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -94.68 -21.41 18.79 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -178.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 69.58 45.66 0.78 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.463 0.649 . . . . 0.0 109.434 -177.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 -151.89 149.69 29.24 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.233 -177.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.458 ' CB ' HD12 ' B' 1338 ' ' LEU . 82.7 m95 -86.98 142.46 27.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.199 176.57 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -123.78 126.29 46.21 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 175.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -75.51 140.35 42.73 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 178.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.8 p -92.29 170.72 9.57 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.144 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -84.37 12.43 6.77 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 178.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 40.4 t -104.39 106.48 20.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-O 120.969 0.414 . . . . 0.0 110.215 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -130.7 116.1 17.57 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 176.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.55 176.39 38.89 Favored Glycine 0 CA--C 1.521 0.443 0 C-N-CA 120.081 -1.056 . . . . 0.0 112.441 -169.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.476 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -80.22 136.63 36.51 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 175.254 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.401 ' HB3' HG21 ' A' ' 31' ' ' VAL . 4.5 t80 -101.8 125.31 48.44 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.293 -175.37 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.476 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 4.9 m-85 -129.46 141.57 50.99 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.791 0.329 . . . . 0.0 110.712 177.015 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.614 HD11 HG23 ' A' ' 116' ' ' ILE . 67.9 mt -101.58 126.38 55.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 171.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.654 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 11.6 m-30 -108.57 138.05 45.51 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.892 0.377 . . . . 0.0 111.335 -177.261 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 61.9 t60 -111.6 143.25 42.78 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.871 173.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 13.4 tpt180 -142.22 147.71 36.97 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.884 177.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -86.9 28.18 0.93 Allowed 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.73 171.3 20.33 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.1 mp0 -63.99 124.38 85.01 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.003 -178.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -79.41 140.97 59.01 Favored 'Cis proline' 0 N--CA 1.497 1.685 0 CA-C-N 121.937 1.728 . . . . 0.0 111.926 -0.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -63.2 -44.26 95.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.941 -177.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -143.32 135.86 27.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.307 0.575 . . . . 0.0 110.837 -177.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.4 t -149.6 150.91 32.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.572 -177.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.466 HG13 HD11 ' A' ' 80' ' ' ILE . 57.7 mt -114.32 137.46 47.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 -178.255 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -131.94 142.16 49.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.581 -177.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.5 mt -120.05 129.41 75.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.247 0.546 . . . . 0.0 109.729 172.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -96.58 99.52 11.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.531 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.2 t-20 -71.23 105.45 3.45 Favored 'General case' 0 N--CA 1.462 0.151 0 O-C-N 123.642 0.589 . . . . 0.0 110.971 -175.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -73.1 -42.43 62.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.235 -171.052 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 60.4 mt -70.9 -45.21 64.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.624 -174.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 54.8 m-20 -95.11 -3.27 48.36 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -175.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.0 m 55.71 43.52 27.83 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 121.452 0.644 . . . . 0.0 110.452 177.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.6 m -125.16 148.87 48.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.52 -178.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.3 p -97.3 132.53 42.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.346 -179.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -123.59 122.1 37.29 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.8 p -125.54 147.68 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-O 120.751 0.31 . . . . 0.0 111.237 -178.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -149.77 126.55 5.34 Favored Pre-proline 0 CA--C 1.537 0.473 0 CA-C-O 118.665 -0.684 . . . . 0.0 110.213 174.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -75.27 150.94 37.71 Favored 'Trans proline' 0 N--CA 1.498 1.765 0 C-N-CA 121.46 1.44 . . . . 0.0 112.265 178.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.466 HD11 HG13 ' A' ' 65' ' ' ILE . 67.0 mt -90.65 138.92 18.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.929 0.395 . . . . 0.0 110.302 178.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.4 p -132.1 155.65 47.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.706 177.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -94.04 36.68 3.65 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.002 -178.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.9 m -111.12 -22.97 11.17 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 173.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.7 mt -69.13 146.44 52.51 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 120.898 0.38 . . . . 0.0 111.373 -176.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.3 tt0 -115.78 135.93 53.54 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.662 175.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.1 mt -112.03 158.58 19.38 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.07 0.462 . . . . 0.0 111.058 -176.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -147.87 140.22 24.4 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.957 -0.756 . . . . 0.0 108.957 177.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.1 t -106.94 109.34 21.21 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.386 -177.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -106.83 103.68 48.25 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 169.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.1 145.25 78.48 Favored 'Trans proline' 0 N--CA 1.498 1.779 0 CA-C-N 120.391 1.175 . . . . 0.0 112.037 -170.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -92.61 17.53 41.6 Favored 'Cis proline' 0 N--CA 1.499 1.84 0 CA-C-N 120.893 1.355 . . . . 0.0 113.346 -3.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -104.89 162.11 13.61 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 110.337 -0.246 . . . . 0.0 110.337 -177.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 32.8 tp -115.72 133.48 55.99 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 122.062 -0.399 . . . . 0.0 111.177 -179.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.47 HD11 ' CG2' ' A' ' 102' ' ' ILE . 9.5 tp -122.53 140.42 52.79 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.252 -175.086 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -142.89 154.96 44.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.768 0.318 . . . . 0.0 110.492 176.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.8 mtm105 -101.96 146.65 27.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.71 -178.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -127.14 163.4 23.9 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.668 0.746 . . . . 0.0 111.414 -177.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 31.6 mp0 -48.33 147.17 2.44 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.112 -177.062 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 64.31 30.96 13.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.118 -0.946 . . . . 0.0 112.176 179.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 48.9 m 67.29 35.24 4.48 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.901 0.381 . . . . 0.0 111.631 165.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -99.82 151.36 21.37 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 178.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.575 HD13 ' CH2' ' B' 1345 ' ' TRP . 76.4 mt -114.71 126.51 72.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -178.504 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -137.21 149.72 47.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.13 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -147.39 169.42 28.34 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.001 -175.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -125.16 136.81 53.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.364 -0.418 . . . . 0.0 110.415 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 46.2 t90 -104.47 125.17 50.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.509 176.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.469 ' CD2' HG22 ' A' ' 31' ' ' VAL . 77.4 m-85 -112.22 140.91 46.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.733 -177.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -51.49 -40.78 60.21 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.81 179.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -129.06 136.55 50.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.671 0.272 . . . . 0.0 110.462 -179.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.2 p -63.14 -41.52 99.3 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.309 -177.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -60.38 -44.81 95.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.514 0.673 . . . . 0.0 109.985 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -55.98 -43.48 77.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.206 178.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 51.6 t -59.35 -41.46 89.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.527 177.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -58.65 -44.59 90.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.618 -176.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -60.56 -49.33 77.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.748 -177.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.614 HG23 HD11 ' A' ' 54' ' ' ILE . 30.4 mm -58.29 -45.91 89.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.099 0.476 . . . . 0.0 110.077 -178.109 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 78.0 p -59.99 -43.5 95.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.702 -177.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.66 -43.27 94.44 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.68 -0.968 . . . . 0.0 110.68 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.494 HD13 ' HB2' ' A' ' 26' ' ' ASP . 10.6 mt -59.83 -49.8 76.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.017 0.436 . . . . 0.0 110.686 -178.036 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 59.0 t -59.01 -42.67 86.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.148 -178.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -58.45 -43.03 88.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.861 0.362 . . . . 0.0 110.639 -178.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.25 -40.58 98.78 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.335 -0.706 . . . . 0.0 111.335 -179.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 34.8 mt -63.08 -42.97 99.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.794 0.33 . . . . 0.0 111.077 178.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 40.5 mt . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.435 -177.061 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B 1338 ' ' LEU . . . . . 0.458 HD12 ' CB ' ' A' ' 43' ' ' TRP . 13.9 mt . . . . . 0 CA--C 1.531 0.231 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -79.14 139.9 15.32 Favored 'Trans proline' 0 N--CA 1.491 1.361 0 C-N-CA 121.182 1.255 . . . . 0.0 111.221 174.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -97.06 125.77 44.78 Favored Pre-proline 0 CA--C 1.534 0.363 0 CA-C-O 118.721 -0.657 . . . . 0.0 109.997 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -72.57 155.43 54.76 Favored 'Trans proline' 0 N--CA 1.496 1.664 0 C-N-CA 121.383 1.389 . . . . 0.0 111.681 173.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.05 157.0 6.63 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 121.31 1.34 . . . . 0.0 111.613 178.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.3 tp -49.9 -29.94 9.18 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -177.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 56.8 t80 -55.15 -37.7 67.3 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.833 0.349 . . . . 0.0 111.207 -177.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B 1345 ' ' TRP . . . . . 0.575 ' CH2' HD13 ' A' ' 102' ' ' ILE . 20.3 t90 -61.11 -48.14 83.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.256 -177.059 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -62.02 -47.83 83.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.007 0.432 . . . . 0.0 110.531 -177.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -59.33 -44.59 92.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.838 -177.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -58.99 -46.59 87.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.699 -176.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.09 -47.88 84.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.721 -177.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.006 -176.725 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 87.0 p . . . . . 0 N--CA 1.458 -0.042 0 CA-C-O 120.937 0.398 . . . . 0.0 110.377 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mm -60.19 -45.2 96.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.215 -178.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.8 m -59.3 -44.45 92.52 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.525 -177.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -59.31 -45.99 89.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.542 -178.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.5 mtt -58.21 -44.18 88.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.126 0.489 . . . . 0.0 110.428 -178.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -60.09 -48.24 82.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.292 -178.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.664 ' HA ' HD12 ' A' ' 14' ' ' ILE . 9.8 tp -60.83 -32.35 71.74 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.193 -178.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.7 -50.2 72.09 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.668 0.27 . . . . 0.0 110.636 178.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.55 -41.91 86.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.031 0.443 . . . . 0.0 110.418 179.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.699 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 97.7 mt -54.17 -52.96 32.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.654 178.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -53.35 -23.42 9.37 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -59.53 -33.83 71.88 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -177.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.7 mm -108.5 -42.43 5.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.823 0.344 . . . . 0.0 110.173 -177.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -117.09 77.85 9.46 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.18 -177.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -55.04 -21.07 25.63 Favored 'Trans proline' 0 N--CA 1.498 1.753 0 C-N-CA 121.516 1.477 . . . . 0.0 113.529 -175.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.1 p90 -90.87 9.96 28.21 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.574 0.954 . . . . 0.0 113.574 -174.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.53 127.87 33.66 Favored 'General case' 0 C--O 1.231 0.123 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 175.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 69.1 tttt -97.46 -40.47 8.66 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.651 -176.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -157.93 155.81 30.18 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.679 -0.408 . . . . 0.0 111.38 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 37.0 mt -89.79 140.16 16.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.951 177.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.6 t -92.74 -47.13 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.83 176.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.496 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.0 t0 -156.49 158.97 38.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.884 178.466 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.5 p -143.24 134.58 26.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.162 0.506 . . . . 0.0 111.323 -179.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 24.1 t -109.58 124.69 51.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.598 176.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.0 t -54.36 -38.88 66.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.302 -172.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -149.11 125.85 11.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.205 0.526 . . . . 0.0 111.81 -178.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.454 HG21 ' HB3' ' A' ' 52' ' ' PHE . 87.3 t -145.18 139.28 22.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 114.986 -1.006 . . . . 0.0 109.506 -177.524 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.04 149.83 50.7 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.041 -178.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.607 ' CD2' HG21 ' A' ' 46' ' ' THR . 12.8 t80 -96.61 133.44 41.11 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.379 0.609 . . . . 0.0 111.884 -176.262 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -127.79 139.87 52.4 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.222 177.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 93.8 m -122.73 146.15 47.76 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -108.22 130.6 55.14 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.862 0.363 . . . . 0.0 110.317 176.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 29.9 t-20 -101.54 116.24 32.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.998 -0.547 . . . . 0.0 109.983 177.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.8 m -68.13 -33.05 73.77 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.902 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.0 p -62.23 -37.02 83.8 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.178 -177.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -95.56 -21.41 18.28 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -178.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 69.0 45.29 0.93 Allowed 'General case' 0 C--O 1.231 0.108 0 CA-C-O 121.424 0.631 . . . . 0.0 109.489 -177.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 32.0 tp10 -156.05 152.37 27.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.013 -177.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.45 ' CB ' HD12 ' B' 1338 ' ' LEU . 85.2 m95 -86.78 143.67 27.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.296 176.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.7 tp10 -125.0 129.42 50.29 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 176.14 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 20.4 pttp -75.11 138.86 42.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.127 177.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.607 HG21 ' CD2' ' A' ' 33' ' ' PHE . 68.5 p -92.4 167.57 11.89 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.16 -178.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -82.94 12.29 5.11 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 178.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.1 t -101.29 106.53 19.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-O 120.962 0.41 . . . . 0.0 110.289 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -130.7 113.87 14.69 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 176.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.67 176.57 38.97 Favored Glycine 0 CA--C 1.52 0.391 0 C-N-CA 120.221 -0.99 . . . . 0.0 112.322 -169.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.465 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -80.91 134.93 35.82 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 175.341 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.454 ' HB3' HG21 ' A' ' 31' ' ' VAL . 7.9 t80 -98.51 129.64 45.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.849 0.356 . . . . 0.0 110.201 -176.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.465 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.7 m-85 -132.96 143.53 49.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.237 177.516 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.668 HD11 HG23 ' A' ' 116' ' ' ILE . 69.0 mt -101.58 128.65 53.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 172.328 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.699 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 12.3 m-30 -108.58 135.78 49.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.843 0.354 . . . . 0.0 111.183 -175.473 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 50.1 t60 -118.34 143.26 46.75 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.238 176.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 60.0 ttt180 -141.97 147.92 37.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.147 178.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -86.83 28.07 0.93 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 178.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -159.1 167.36 29.4 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 -63.94 128.47 92.99 Favored Pre-proline 0 CA--C 1.538 0.509 0 CA-C-O 118.436 -0.793 . . . . 0.0 110.002 -178.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -74.94 140.93 70.08 Favored 'Cis proline' 0 N--CA 1.497 1.722 0 CA-C-N 121.943 1.729 . . . . 0.0 111.753 -1.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -65.45 -47.06 77.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.085 -177.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -142.69 137.37 29.83 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.431 0.634 . . . . 0.0 110.936 -176.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.0 t -151.14 152.28 33.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.45 -177.244 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.414 HG13 HD11 ' A' ' 80' ' ' ILE . 41.8 mt -107.04 141.61 21.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -131.74 141.93 49.65 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.371 -177.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.3 mt -128.38 131.42 69.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.25 0.548 . . . . 0.0 110.237 174.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -98.76 99.47 10.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 114.957 -1.019 . . . . 0.0 109.626 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -73.74 105.88 5.23 Favored 'General case' 0 N--CA 1.463 0.188 0 O-C-N 123.679 0.612 . . . . 0.0 110.717 -176.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 -73.64 -41.3 62.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.587 -170.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 66.5 mt -72.17 -45.21 61.36 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.551 -174.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 57.5 m-20 -95.07 -3.32 48.41 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.702 1.001 . . . . 0.0 113.702 -175.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.416 HG22 ' O ' ' A' ' 73' ' ' THR . 10.9 m 54.72 43.53 29.97 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 121.516 0.674 . . . . 0.0 110.748 176.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 32.6 m -126.99 145.21 50.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.511 -178.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 13.6 p -90.75 130.91 36.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.25 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -119.41 122.32 41.5 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 175.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 34.6 t -125.4 145.14 33.26 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-O 120.614 0.245 . . . . 0.0 110.623 -177.202 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -148.68 126.39 5.73 Favored Pre-proline 0 CA--C 1.538 0.501 0 CA-C-O 118.747 -0.644 . . . . 0.0 110.498 174.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -75.27 150.91 37.69 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 121.621 1.547 . . . . 0.0 111.891 175.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.414 HD11 HG13 ' A' ' 65' ' ' ILE . 66.4 mt -93.68 120.35 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.156 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.416 179.071 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 68.3 p -99.33 154.25 18.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.785 175.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -93.7 26.49 16.01 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.721 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.5 t -111.04 -12.86 14.16 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.411 0.522 . . . . 0.0 112.411 174.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 78.0 mt -67.52 146.14 54.23 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.072 0.463 . . . . 0.0 111.262 -176.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.1 tt0 -117.62 135.85 53.7 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.801 176.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 63.0 mt -112.18 155.56 23.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.923 0.392 . . . . 0.0 110.8 -177.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -147.55 144.16 28.31 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.079 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.0 t -99.48 109.09 21.68 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.668 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -106.77 103.78 48.5 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 171.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.18 143.52 44.31 Favored 'Trans proline' 0 N--CA 1.496 1.671 0 CA-C-N 120.527 1.224 . . . . 0.0 112.329 -169.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -90.4 14.93 48.91 Favored 'Cis proline' 0 N--CA 1.499 1.842 0 CA-C-N 121.05 1.411 . . . . 0.0 113.481 -4.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -95.46 170.67 9.2 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 122.419 0.288 . . . . 0.0 110.776 -177.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 52.4 tp -116.32 133.47 55.99 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 174.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.441 HD11 ' CG2' ' A' ' 102' ' ' ILE . 11.1 tp -125.09 140.51 52.82 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.392 -173.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 48.0 p90 -142.97 150.08 39.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.943 0.402 . . . . 0.0 110.523 175.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 26.5 mtm180 -102.37 146.9 27.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.26 -175.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -128.46 157.17 41.85 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.901 0.857 . . . . 0.0 111.367 -179.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 54.6 tt0 -49.57 150.05 2.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.724 -177.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 64.56 30.95 12.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.241 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 42.1 t 68.88 35.27 2.97 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.005 0.431 . . . . 0.0 111.645 164.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -98.96 140.61 32.85 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 177.531 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.441 ' CG2' HD11 ' A' ' 94' ' ' LEU . 78.9 mt -114.75 124.05 71.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -177.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -135.14 146.1 48.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.423 -178.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -144.33 169.35 26.4 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 120.888 -0.673 . . . . 0.0 111.648 -177.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -126.16 142.81 51.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.027 0.441 . . . . 0.0 110.752 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 73.7 t90 -106.31 125.01 50.47 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.443 174.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.437 ' CD1' HG22 ' A' ' 31' ' ' VAL . 64.5 m-85 -111.29 139.69 46.48 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 123.281 0.363 . . . . 0.0 110.611 -179.138 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -51.74 -37.53 51.46 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.678 179.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -132.54 136.06 46.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.42 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 84.5 p -62.8 -41.62 99.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.303 -177.507 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -59.85 -44.02 94.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.509 0.671 . . . . 0.0 110.016 178.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -56.51 -44.67 80.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.067 178.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 50.2 t -59.2 -39.72 83.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.519 177.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -58.89 -45.94 89.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.852 0.358 . . . . 0.0 110.642 -177.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 22.8 ttp-105 -61.33 -50.16 74.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.791 -177.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.668 HG23 HD11 ' A' ' 54' ' ' ILE . 30.2 mm -58.56 -44.16 88.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.051 0.453 . . . . 0.0 110.0 -178.19 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 59.7 p -59.85 -43.99 94.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.698 -177.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.56 -43.75 94.08 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 -178.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.496 HD13 ' HB2' ' A' ' 26' ' ' ASP . 12.0 mt -58.97 -48.5 81.31 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.05 0.453 . . . . 0.0 110.598 -178.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 54.5 t -59.07 -44.3 91.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.067 -178.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -57.39 -42.14 81.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.63 -178.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.9 -45.25 96.56 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -179.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 62.1 mt -58.65 -42.19 87.81 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.926 0.393 . . . . 0.0 110.642 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 88.0 mt . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.867 -178.988 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B 1338 ' ' LEU . . . . . 0.45 HD12 ' CB ' ' A' ' 43' ' ' TRP . 19.9 mt . . . . . 0 C--O 1.234 0.262 0 CA-C-O 118.493 -0.765 . . . . 0.0 109.613 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -79.15 139.63 15.13 Favored 'Trans proline' 0 N--CA 1.493 1.455 0 CA-C-N 120.394 1.176 . . . . 0.0 111.193 174.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 6.7 mtmp? -97.28 125.99 43.51 Favored Pre-proline 0 CA--C 1.535 0.403 0 CA-C-O 118.343 -0.837 . . . . 0.0 110.119 178.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -61.86 165.34 14.3 Favored 'Trans proline' 0 N--CA 1.497 1.722 0 CA-C-N 120.657 1.27 . . . . 0.0 111.655 177.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -49.27 156.98 2.2 Favored 'Trans proline' 0 N--CA 1.497 1.679 0 C-N-CA 121.395 1.397 . . . . 0.0 111.866 178.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B 1343 ' ' LEU . . . . . 0.515 ' H ' HD12 ' B' 1343 ' ' LEU . 6.2 mp -50.17 -29.19 8.74 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -176.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -56.4 -35.79 68.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.733 0.301 . . . . 0.0 111.429 -176.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 54.9 t90 -60.77 -48.14 83.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.955 0.407 . . . . 0.0 110.465 -176.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -65.23 -48.11 74.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.921 0.391 . . . . 0.0 110.804 -178.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -57.81 -44.39 86.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.964 0.412 . . . . 0.0 110.758 -176.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -59.19 -47.9 83.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.398 -177.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -57.82 -45.27 86.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.684 -177.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.319 -176.427 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.2 p . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.976 0.417 . . . . 0.0 110.427 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.2 mm -60.18 -44.44 95.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.198 -179.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.4 m -59.05 -44.71 91.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.991 0.424 . . . . 0.0 110.534 -177.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -59.36 -47.12 86.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.4 -178.472 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 87.2 mtp -58.29 -42.49 86.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.127 0.489 . . . . 0.0 110.41 -178.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -59.88 -48.5 81.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.298 -178.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.671 ' HA ' HD12 ' A' ' 14' ' ' ILE . 8.7 tp -60.4 -33.43 72.47 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.127 -178.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.5 -50.03 73.03 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.65 0.262 . . . . 0.0 110.688 179.041 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.11 -41.18 87.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.952 0.406 . . . . 0.0 110.565 179.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.703 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 96.8 mt -54.19 -52.88 33.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.618 178.507 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -53.61 -24.06 12.86 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -177.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.7 mtpt -60.25 -33.07 71.79 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -177.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 45.8 mm -109.12 -41.25 4.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.802 0.334 . . . . 0.0 110.407 -176.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -116.27 77.82 7.66 Favored Pre-proline 0 CA--C 1.535 0.392 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.311 -177.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -53.72 -20.46 17.06 Favored 'Trans proline' 0 N--CA 1.498 1.784 0 C-N-CA 121.469 1.446 . . . . 0.0 113.427 -176.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.2 p90 -94.42 17.63 12.66 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -174.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -92.45 127.5 37.96 Favored 'General case' 0 C--O 1.232 0.133 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 173.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.463 ' O ' HD21 ' A' ' 11' ' ' LEU . 79.2 tttt -101.57 -40.61 6.94 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.75 -176.338 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -150.59 156.37 41.25 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.976 0.417 . . . . 0.0 111.336 -179.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 58.1 mt -93.09 136.5 24.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.174 177.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.1 t -88.44 -47.1 15.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.753 176.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.495 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -152.34 157.01 40.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.865 177.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.4 p -143.29 131.98 22.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.988 0.423 . . . . 0.0 111.056 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.6 t -109.13 126.17 52.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.706 177.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.2 t -54.47 -39.08 67.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.243 -171.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -150.21 127.04 11.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.242 0.544 . . . . 0.0 111.722 -178.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.472 HG21 ' HB3' ' A' ' 52' ' ' PHE . 94.6 t -145.14 140.5 22.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.437 -177.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.46 149.81 51.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.14 -177.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -97.91 132.08 43.81 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.249 0.547 . . . . 0.0 111.588 -176.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -125.61 142.31 51.57 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.759 179.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 80.4 m -120.81 148.14 44.41 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.184 -0.672 . . . . 0.0 109.184 177.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -109.48 131.97 54.56 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.975 0.417 . . . . 0.0 110.483 176.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -104.25 116.15 31.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.969 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 85.1 p -69.85 -31.03 68.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.137 -176.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -61.9 -38.1 87.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.662 0.267 . . . . 0.0 110.914 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -95.49 -21.42 18.32 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -178.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 28.3 t30 69.16 43.67 1.07 Allowed 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.366 0.603 . . . . 0.0 109.739 -177.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -151.07 164.52 36.27 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.99 -177.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 85.0 m95 -96.01 141.55 29.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.468 178.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -123.88 127.46 48.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.945 177.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.9 ttpp -75.1 139.96 43.12 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 62.3 p -92.34 173.35 7.85 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.088 -179.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -84.83 12.6 7.07 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 178.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.7 t -104.28 106.48 20.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 121.0 0.428 . . . . 0.0 110.311 179.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -130.47 115.03 16.26 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 176.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.63 176.51 38.95 Favored Glycine 0 CA--C 1.52 0.367 0 C-N-CA 120.08 -1.057 . . . . 0.0 112.182 -169.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.454 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -81.36 136.51 35.74 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 175.474 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.472 ' HB3' HG21 ' A' ' 31' ' ' VAL . 8.9 t80 -99.15 129.91 45.43 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.085 -176.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.454 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 9.1 m-85 -133.46 143.13 48.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.287 177.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.678 HD11 HG23 ' A' ' 116' ' ' ILE . 69.9 mt -101.65 128.14 54.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 172.324 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.703 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 13.7 m-30 -108.42 134.39 51.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.836 0.351 . . . . 0.0 111.136 -174.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 59.6 t60 -119.68 140.09 51.2 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.19 176.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.3 tpt180 -142.15 149.84 40.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.709 177.056 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -86.85 28.12 0.93 Allowed 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.79 170.19 22.93 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -64.13 125.98 89.26 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-O 118.46 -0.781 . . . . 0.0 110.005 -178.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.65 140.93 65.37 Favored 'Cis proline' 0 N--CA 1.497 1.682 0 CA-C-N 121.844 1.694 . . . . 0.0 111.833 -1.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -65.7 -47.71 74.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.059 -177.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -142.15 135.38 28.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.458 0.647 . . . . 0.0 110.926 -176.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.0 t -150.93 152.36 33.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.413 -177.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.2 mt -107.93 140.13 27.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -131.73 142.0 49.67 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.625 -177.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.0 mt -127.89 130.9 70.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.238 0.542 . . . . 0.0 110.053 173.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -99.21 99.61 10.61 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.753 -179.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -71.69 105.07 3.56 Favored 'General case' 0 C--N 1.332 -0.183 0 O-C-N 123.757 0.661 . . . . 0.0 110.672 -177.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -72.52 -42.05 65.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.5 -170.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.8 mt -71.95 -45.27 61.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.702 -174.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 54.7 m-20 -95.02 -3.35 48.52 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -175.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.9 m 54.94 43.6 29.65 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.399 0.619 . . . . 0.0 110.648 177.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.7 m -125.35 141.59 51.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.531 -178.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 14.8 p -88.15 130.18 35.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.291 -179.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -118.85 122.29 42.0 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 175.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 30.3 t -125.5 145.75 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 120.678 0.275 . . . . 0.0 110.532 -177.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -149.14 126.36 5.52 Favored Pre-proline 0 CA--C 1.538 0.488 0 CA-C-O 118.698 -0.667 . . . . 0.0 110.561 174.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -75.41 150.95 37.12 Favored 'Trans proline' 0 N--CA 1.498 1.757 0 C-N-CA 121.463 1.442 . . . . 0.0 112.305 177.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 69.2 mt -92.65 133.93 32.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 CA-C-O 120.977 0.418 . . . . 0.0 110.249 178.122 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.0 p -132.14 158.48 41.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.775 177.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -94.68 35.03 4.4 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.026 -178.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.7 t -108.47 -23.31 11.92 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 173.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.5 mt -68.36 148.58 50.5 Favored 'General case' 0 C--O 1.23 0.077 0 CA-C-O 120.922 0.391 . . . . 0.0 111.324 -176.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.5 tt0 -118.16 135.84 53.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.784 176.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.4 mt -113.9 157.93 21.74 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.075 0.464 . . . . 0.0 111.0 -176.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -148.14 139.54 23.56 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.2 t -97.33 109.17 21.98 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.793 -179.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -106.71 103.74 48.16 Favored Pre-proline 0 C--N 1.329 -0.321 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 172.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -71.18 139.61 35.74 Favored 'Trans proline' 0 N--CA 1.496 1.676 0 CA-C-N 120.619 1.257 . . . . 0.0 112.002 -171.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -89.11 9.0 65.74 Favored 'Cis proline' 0 N--CA 1.501 1.943 0 CA-C-N 121.213 1.469 . . . . 0.0 113.764 -4.282 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -84.62 170.11 13.69 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.7 0.286 . . . . 0.0 111.223 -177.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 53.7 tp -118.66 131.75 56.17 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 170.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.449 HD11 ' CG2' ' A' ' 102' ' ' ILE . 11.6 tp -123.63 139.56 53.87 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 110.408 -0.219 . . . . 0.0 110.408 -174.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 11.7 p90 -144.49 151.3 38.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.938 0.399 . . . . 0.0 110.651 176.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.4 mtm180 -102.13 148.93 24.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.023 -176.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -130.91 165.65 22.63 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.841 0.829 . . . . 0.0 111.666 -178.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -48.39 148.17 2.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.092 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 71.9 mtt85 63.17 30.86 15.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.212 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 52.1 m 66.55 35.18 5.57 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.921 0.391 . . . . 0.0 111.598 166.108 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -98.16 149.45 22.52 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 178.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.616 HD13 ' CH2' ' B' 1345 ' ' TRP . 82.4 mt -117.89 127.84 75.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 121.064 0.459 . . . . 0.0 109.824 -177.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -135.99 150.38 49.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.382 177.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -142.25 169.36 25.43 Favored Glycine 0 CA--C 1.522 0.53 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 -176.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -125.38 139.45 53.66 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.847 0.356 . . . . 0.0 110.622 -179.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 7.4 t90 -107.75 127.55 53.78 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.57 175.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.451 ' CD2' HG22 ' A' ' 31' ' ' VAL . 71.4 m-85 -116.14 144.2 44.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.832 0.349 . . . . 0.0 110.682 -179.743 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -51.57 -37.49 49.98 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.626 178.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -134.06 135.92 43.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.846 0.355 . . . . 0.0 110.531 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.8 m -61.33 -42.01 97.98 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.098 -177.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -59.46 -43.5 93.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.401 0.62 . . . . 0.0 110.081 178.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -56.31 -44.84 80.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.084 178.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 42.9 t -59.94 -39.85 86.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.708 178.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -59.28 -45.31 91.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.771 0.319 . . . . 0.0 110.608 -177.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -60.08 -49.13 78.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.518 -177.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.678 HG23 HD11 ' A' ' 54' ' ' ILE . 35.3 mm -58.43 -45.49 89.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.047 0.451 . . . . 0.0 110.094 -178.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 68.3 p -59.72 -43.34 94.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.756 -177.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.74 -44.36 94.17 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 110.66 -0.976 . . . . 0.0 110.66 -179.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.495 HD13 ' HB2' ' A' ' 26' ' ' ASP . 10.8 mt -58.77 -48.29 81.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.081 0.467 . . . . 0.0 110.503 -178.403 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 52.0 t -58.91 -43.78 89.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.171 -178.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -57.46 -42.41 82.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.635 -178.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.32 -43.16 99.47 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 78.2 mt -61.79 -41.37 97.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.833 0.349 . . . . 0.0 111.044 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 27.6 mt . . . . . 0 C--N 1.327 -0.373 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.682 -177.263 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 10.8 mt . . . . . 0 C--O 1.233 0.218 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -79.14 139.73 15.2 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 C-N-CA 121.101 1.201 . . . . 0.0 111.241 175.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -97.3 125.96 43.59 Favored Pre-proline 0 CA--C 1.537 0.448 0 CA-C-O 118.474 -0.774 . . . . 0.0 109.915 178.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -78.17 169.05 20.91 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 121.272 1.315 . . . . 0.0 111.792 176.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -62.0 156.59 48.56 Favored 'Trans proline' 0 N--CA 1.495 1.616 0 C-N-CA 121.261 1.308 . . . . 0.0 111.41 177.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.9 tp -50.04 -28.55 7.22 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.451 0.538 . . . . 0.0 112.451 -176.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 67.9 t80 -54.84 -37.31 66.02 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.773 0.32 . . . . 0.0 111.304 -176.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B 1345 ' ' TRP . . . . . 0.616 ' CH2' HD13 ' A' ' 102' ' ' ILE . 46.1 t90 -61.61 -48.07 82.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.411 -176.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -61.88 -48.98 78.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.025 0.441 . . . . 0.0 110.41 -177.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -58.92 -45.13 91.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.879 -176.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -59.28 -47.03 86.89 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.651 -176.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.23 -47.21 86.95 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.779 -177.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 . . . . . 0 C--N 1.327 -0.395 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.522 -173.873 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 85.8 p . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.988 0.423 . . . . 0.0 110.558 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.9 mm -60.43 -44.47 96.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.193 -178.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 35.2 m -59.41 -45.54 91.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.931 0.396 . . . . 0.0 110.499 -177.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -59.77 -45.42 92.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.553 -178.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 44.7 ttm -58.27 -43.04 87.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.049 0.452 . . . . 0.0 110.382 -178.34 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -60.5 -49.62 76.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.348 -178.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.75 ' HA ' HD12 ' A' ' 14' ' ' ILE . 13.7 tp -61.52 -30.67 70.78 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.412 -178.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.12 -50.12 71.75 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.621 0.248 . . . . 0.0 110.527 178.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.86 -41.05 86.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.976 0.417 . . . . 0.0 110.565 178.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.75 HD12 ' HA ' ' A' ' 11' ' ' LEU . 95.7 mt -54.21 -52.98 32.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.643 178.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 76.7 mttt -55.08 -26.8 40.32 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -177.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -61.98 -29.92 70.58 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 -177.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.7 mm -109.76 -40.49 4.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.699 0.285 . . . . 0.0 110.391 -176.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -115.37 83.23 10.28 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.241 -178.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -54.22 -21.39 22.39 Favored 'Trans proline' 0 N--CA 1.498 1.751 0 C-N-CA 121.444 1.429 . . . . 0.0 113.549 -175.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 34.7 p90 -97.29 20.52 11.38 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -175.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -102.89 130.87 50.07 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 173.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.487 ' O ' HD21 ' A' ' 11' ' ' LEU . 55.5 tttm -119.74 -35.19 3.57 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.625 0.25 . . . . 0.0 111.571 -175.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 85.4 tt0 -128.94 144.6 51.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.852 0.358 . . . . 0.0 110.585 -177.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.489 HG13 HD13 ' A' ' 11' ' ' LEU . 58.3 mt -99.04 131.02 47.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.803 173.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.3 t -90.42 -47.19 14.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.375 -0.375 . . . . 0.0 109.992 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.51 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -156.95 157.08 34.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.951 178.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.9 p -142.71 132.0 23.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.224 0.535 . . . . 0.0 111.293 -179.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.554 ' HG ' ' HD2' ' A' ' 107' ' ' PHE . 35.4 t -105.41 123.73 48.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.526 176.247 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 88.1 p -53.97 -37.16 63.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.455 -172.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -151.1 126.27 9.91 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.128 0.49 . . . . 0.0 111.449 -179.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.409 HG21 ' HB3' ' A' ' 52' ' ' PHE . 99.0 t -145.2 136.53 20.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.671 -177.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -127.47 149.85 49.92 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.966 -178.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -99.26 132.03 44.87 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-O 121.29 0.567 . . . . 0.0 111.931 -176.269 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -126.21 141.62 51.85 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.348 178.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.5 m -122.06 145.0 48.57 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 177.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -108.3 131.94 54.21 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.929 0.395 . . . . 0.0 110.451 176.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -102.99 114.34 28.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.858 176.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.4 m -67.86 -32.37 72.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.026 -177.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -62.32 -37.49 85.78 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.665 0.269 . . . . 0.0 111.129 -177.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -95.09 -21.48 18.52 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 32.0 t30 69.17 46.03 0.83 Allowed 'General case' 0 C--O 1.231 0.11 0 CA-C-O 121.505 0.669 . . . . 0.0 109.441 -177.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 72.7 tt0 -155.43 152.72 29.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.865 -177.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -89.34 143.76 26.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.387 177.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -124.35 128.53 49.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.832 176.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 26.4 pttm -75.45 140.16 42.71 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.031 178.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 52.5 p -92.3 170.21 9.97 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.111 -178.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -83.83 12.58 5.85 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 177.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.7 t -104.07 106.49 20.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.067 0.46 . . . . 0.0 110.281 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -132.38 115.79 16.03 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 176.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.41 38.97 Favored Glycine 0 CA--C 1.519 0.341 0 C-N-CA 120.153 -1.022 . . . . 0.0 112.5 -169.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.492 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -81.42 133.42 35.41 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 174.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.409 ' HB3' HG21 ' A' ' 31' ' ' VAL . 4.8 t80 -98.46 128.03 44.65 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -175.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.492 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.0 m-85 -132.43 142.66 49.35 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.353 177.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.626 HD11 HG23 ' A' ' 116' ' ' ILE . 69.6 mt -101.64 127.94 54.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 171.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.704 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 15.6 m-30 -108.47 135.55 49.56 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.812 0.339 . . . . 0.0 111.242 -176.299 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 37.1 t60 -114.9 143.26 45.42 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.935 173.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.5 tpt85 -142.1 148.94 39.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.456 . . . . 0.0 109.986 176.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -86.87 28.11 0.93 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.29 159.27 37.38 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -63.88 134.46 95.92 Favored Pre-proline 0 CA--C 1.537 0.475 0 CA-C-O 118.651 -0.69 . . . . 0.0 110.141 -175.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -67.43 140.81 54.57 Favored 'Cis proline' 0 N--CA 1.498 1.779 0 CA-C-N 121.603 1.608 . . . . 0.0 111.371 -3.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -68.54 -47.83 65.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.154 -177.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . 0.473 ' HB3' HD12 ' A' ' 80' ' ' ILE . 76.8 m80 -142.57 135.61 28.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.322 0.582 . . . . 0.0 110.84 -177.014 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 5.2 t -149.82 152.2 34.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.35 -176.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 56.4 mt -110.45 139.51 33.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.596 -179.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -131.75 142.12 49.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.723 -176.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.5 mt -123.15 127.1 74.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.144 0.497 . . . . 0.0 109.783 172.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -93.13 99.54 12.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.505 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -73.4 105.52 4.81 Favored 'General case' 0 C--N 1.332 -0.189 0 O-C-N 123.818 0.699 . . . . 0.0 110.881 -175.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 69.3 mtm180 -73.04 -42.43 63.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.602 -170.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.5 mt -72.94 -45.08 60.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.63 -174.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -94.97 -3.38 48.6 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -175.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 72.0 p 50.8 43.58 28.2 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.429 0.633 . . . . 0.0 111.238 177.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 35.5 m -128.27 131.35 48.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.408 -179.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 77.1 p -74.43 130.02 38.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.429 -179.224 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -117.03 122.2 43.52 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 173.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 39.6 t -125.56 146.8 30.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 120.852 0.358 . . . . 0.0 110.802 -177.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -149.51 126.45 5.41 Favored Pre-proline 0 CA--C 1.538 0.485 0 CA-C-O 118.723 -0.656 . . . . 0.0 110.354 174.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -75.3 150.96 37.62 Favored 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 121.443 1.429 . . . . 0.0 112.033 177.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.473 HD12 ' HB3' ' A' ' 63' ' ' HIS . 65.2 mt -87.12 131.95 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.138 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.586 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.7 p -132.16 157.98 42.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.599 176.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.543 ' HA2' HD22 ' A' ' 124' ' ' LEU . . . -108.83 38.91 3.1 Favored Glycine 0 CA--C 1.523 0.592 0 C-N-CA 121.115 -0.564 . . . . 0.0 111.856 -177.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 10.5 t -103.68 -30.07 10.67 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.767 -0.217 . . . . 0.0 111.156 172.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.23 149.0 44.97 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.828 0.347 . . . . 0.0 111.201 -176.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -106.52 141.71 37.37 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 175.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 66.9 mt -111.8 159.75 18.0 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.789 0.328 . . . . 0.0 110.504 -178.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -151.12 145.19 25.29 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 177.003 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 26.2 t -102.51 109.31 20.9 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.512 178.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -106.81 103.76 48.53 Favored Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 173.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -69.86 140.63 42.78 Favored 'Trans proline' 0 N--CA 1.497 1.7 0 CA-C-N 120.496 1.213 . . . . 0.0 112.074 -170.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -88.95 9.46 64.52 Favored 'Cis proline' 0 N--CA 1.5 1.905 0 CA-C-N 121.193 1.462 . . . . 0.0 113.697 -4.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -86.75 167.79 14.11 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.798 0.333 . . . . 0.0 111.109 -177.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 58.1 tp -115.75 133.97 55.49 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 170.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.474 HD21 ' HZ2' ' B' 1345 ' ' TRP . 12.4 tp -128.4 140.14 52.0 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.557 0.218 . . . . 0.0 110.469 -173.065 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 19.8 p90 -146.94 165.1 30.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.918 0.389 . . . . 0.0 110.592 176.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 37.8 mtt-85 -101.74 148.27 25.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.158 -178.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -128.83 163.94 24.12 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.867 0.841 . . . . 0.0 111.55 -177.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 32.0 mp0 -49.31 147.77 2.98 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.873 -176.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 79.6 mtm180 63.38 30.97 15.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.119 -0.946 . . . . 0.0 112.207 178.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 50.3 m 67.36 35.22 4.42 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.916 0.389 . . . . 0.0 111.535 167.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -101.49 152.71 20.44 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 179.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.519 HD13 ' CH2' ' B' 1345 ' ' TRP . 77.1 mt -111.07 129.6 66.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -179.178 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -137.96 149.39 46.1 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.897 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.96 168.85 26.37 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 111.274 -0.73 . . . . 0.0 111.274 -177.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -125.29 138.61 54.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.815 0.341 . . . . 0.0 110.602 -179.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 7.6 t90 -104.12 122.61 45.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.536 175.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.554 ' HD2' ' HG ' ' A' ' 28' ' ' SER . 35.9 m-85 -112.51 143.02 44.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.771 0.319 . . . . 0.0 110.554 -179.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 72.3 t80 -50.7 -35.87 33.29 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.702 178.38 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.9 t-20 -136.27 134.92 38.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.762 0.315 . . . . 0.0 110.462 179.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.6 t -61.68 -42.07 98.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.089 -177.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 -60.29 -43.54 96.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.375 0.607 . . . . 0.0 110.158 179.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 49.3 tt0 -56.62 -45.88 81.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.604 0.716 . . . . 0.0 110.0 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 38.4 t -60.56 -38.29 84.06 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.854 178.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -58.85 -46.22 88.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.923 0.392 . . . . 0.0 110.44 -177.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 51.2 mtp180 -58.98 -47.63 84.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.073 0.463 . . . . 0.0 110.552 -178.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.626 HG23 HD11 ' A' ' 54' ' ' ILE . 29.1 mm -58.23 -45.64 88.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.085 -179.03 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.0 p -59.29 -42.98 92.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.72 -177.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.6 -44.99 93.71 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.614 -0.995 . . . . 0.0 110.614 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.51 HD13 ' HB2' ' A' ' 26' ' ' ASP . 10.4 mt -58.67 -49.1 78.78 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.181 0.515 . . . . 0.0 110.491 -178.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.465 HG12 HD11 ' A' ' 124' ' ' LEU . 49.3 t -58.53 -41.42 81.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.265 -178.054 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.416 ' HA ' HD12 ' A' ' 124' ' ' LEU . 3.3 m-20 -58.5 -43.76 89.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.89 0.376 . . . . 0.0 110.593 -179.112 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -60.75 -40.78 98.58 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.262 -0.735 . . . . 0.0 111.262 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.9 mt -65.69 -43.06 90.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.645 0.26 . . . . 0.0 111.414 179.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.543 HD22 ' HA2' ' A' ' 82' ' ' GLY . 18.1 mt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.258 -176.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 8.3 mt . . . . . 0 CA--C 1.532 0.283 0 CA-C-O 118.55 -0.738 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -79.13 139.57 15.12 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 CA-C-N 120.211 1.111 . . . . 0.0 111.237 174.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -97.31 125.89 43.84 Favored Pre-proline 0 CA--C 1.536 0.436 0 CA-C-O 118.473 -0.775 . . . . 0.0 110.279 178.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -67.41 160.37 48.09 Favored 'Trans proline' 0 N--CA 1.497 1.712 0 C-N-CA 121.165 1.243 . . . . 0.0 111.627 175.33 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.82 156.86 2.94 Favored 'Trans proline' 0 N--CA 1.497 1.686 0 C-N-CA 121.288 1.326 . . . . 0.0 111.827 178.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.4 tp -50.04 -29.15 8.19 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -176.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 64.9 t80 -54.94 -38.27 67.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.932 0.396 . . . . 0.0 111.164 -177.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B 1345 ' ' TRP . . . . . 0.519 ' CH2' HD13 ' A' ' 102' ' ' ILE . 35.7 t90 -60.6 -48.2 82.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.206 -177.649 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -61.48 -48.18 82.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.965 0.412 . . . . 0.0 110.67 -176.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -60.0 -46.11 90.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.819 -176.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -58.08 -46.31 85.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.693 -175.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -61.56 -51.36 68.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.904 -176.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.343 -174.846 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 24.7 m . . . . . 0 CA--C 1.527 0.066 0 CA-C-O 120.823 0.344 . . . . 0.0 110.857 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.4 mm -59.52 -46.85 92.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.991 0.424 . . . . 0.0 110.041 -179.005 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.4 m -58.68 -44.38 90.21 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.15 0.5 . . . . 0.0 110.449 -178.339 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -59.2 -45.32 91.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.644 -178.571 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 89.6 mtp -58.29 -42.84 87.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.996 0.426 . . . . 0.0 110.463 -178.221 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -59.26 -49.44 77.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.027 0.441 . . . . 0.0 110.146 -178.925 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.707 ' HA ' HD12 ' A' ' 14' ' ' ILE . 14.1 tp -61.31 -30.36 70.45 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.36 -179.609 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.98 -49.91 72.85 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 122.224 -0.298 . . . . 0.0 110.579 177.862 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.94 -41.55 83.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.963 0.411 . . . . 0.0 110.464 178.422 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.72 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 92.6 mt -54.16 -53.03 32.1 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.748 179.23 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.6 mttp -53.8 -27.64 30.47 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -178.134 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -60.46 -32.2 71.18 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -176.503 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.513 HG21 ' CE2' ' A' ' 66' ' ' PHE . 47.3 mm -107.4 -41.08 5.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.864 0.364 . . . . 0.0 110.44 -176.031 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -115.13 83.36 9.83 Favored Pre-proline 0 CA--C 1.534 0.332 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.206 -178.691 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -53.65 -20.8 17.58 Favored 'Trans proline' 0 N--CA 1.498 1.759 0 C-N-CA 121.505 1.47 . . . . 0.0 113.422 -176.254 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -99.23 22.03 11.08 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.756 0.651 . . . . 0.0 112.756 -175.225 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -110.57 127.36 55.18 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 173.262 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.5 ' O ' HD21 ' A' ' 11' ' ' LEU . 16.7 pttp -122.99 -24.54 4.74 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -175.788 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.3 tp10 -127.77 140.26 52.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.726 0.298 . . . . 0.0 110.594 -179.768 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.486 HG13 HD13 ' A' ' 11' ' ' LEU . 52.6 mt -98.1 132.17 43.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.341 -0.39 . . . . 0.0 109.998 174.239 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.1 t -92.87 -47.13 13.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.173 179.938 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.499 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.9 t0 -155.02 156.31 35.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.038 178.69 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.4 p -143.03 131.98 22.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.098 0.475 . . . . 0.0 111.125 179.683 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.3 t -107.22 125.91 51.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.663 177.39 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 87.3 p -54.33 -37.77 65.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.309 -172.255 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -151.84 126.62 9.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.146 0.498 . . . . 0.0 111.688 -178.997 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.428 HG21 ' HB3' ' A' ' 52' ' ' PHE . 99.2 t -145.26 140.17 22.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.474 -177.713 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.15 149.88 50.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.147 -178.067 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.464 ' HD1' HG21 ' A' ' 46' ' ' THR . 32.3 t80 -97.89 133.62 42.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.187 0.518 . . . . 0.0 111.749 -176.383 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.406 ' CD2' HD11 ' B' 1338 ' ' LEU . 31.5 m-85 -126.56 142.0 51.68 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.467 178.973 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.606 HG23 ' CZ ' ' A' ' 103' ' ' ARG . 82.0 m -120.47 146.77 45.92 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.818 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -108.48 131.94 54.31 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.988 0.423 . . . . 0.0 110.471 176.125 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 -104.37 115.98 31.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.962 177.51 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 87.9 p -69.06 -31.46 70.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.064 -176.816 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.2 t -60.9 -39.84 90.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.763 0.316 . . . . 0.0 110.876 -177.58 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -94.43 -21.38 18.96 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -178.703 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 69.79 43.62 0.93 Allowed 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.355 0.598 . . . . 0.0 109.748 -177.922 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -151.26 162.9 40.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.103 -177.77 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.457 ' CB ' HD12 ' B' 1338 ' ' LEU . 88.0 m95 -94.76 142.53 27.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.373 177.639 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -124.34 126.69 46.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 0.0 109.905 175.527 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 38.8 tttp -73.95 139.81 45.13 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.394 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.464 HG21 ' HD1' ' A' ' 33' ' ' PHE . 67.2 p -92.4 171.89 8.75 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.153 -178.365 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -83.75 12.49 5.88 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 178.681 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.5 t -102.43 106.47 19.94 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-O 120.964 0.411 . . . . 0.0 110.291 179.719 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -131.1 114.89 15.7 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 176.717 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.61 176.52 38.93 Favored Glycine 0 CA--C 1.519 0.295 0 C-N-CA 120.054 -1.069 . . . . 0.0 112.411 -169.67 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.489 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -81.26 134.7 35.64 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 175.145 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.428 ' HB3' HG21 ' A' ' 31' ' ' VAL . 5.4 t80 -98.3 127.57 44.3 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.079 -176.473 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.489 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.0 m-85 -131.84 142.27 49.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.276 177.654 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.689 HD11 HG23 ' A' ' 116' ' ' ILE . 68.5 mt -101.59 127.71 54.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 172.308 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.72 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.3 m-30 -108.47 136.86 47.38 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.838 0.352 . . . . 0.0 111.216 -175.922 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 68.2 t60 -114.68 141.64 47.55 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.34 175.295 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -142.31 146.93 35.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.835 176.459 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -86.77 28.09 0.92 Allowed 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.998 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.37 172.8 17.69 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.765 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -64.04 124.68 86.07 Favored Pre-proline 0 CA--C 1.539 0.535 0 CA-C-O 118.55 -0.738 . . . . 0.0 110.081 -178.129 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -79.11 140.98 60.46 Favored 'Cis proline' 0 N--CA 1.495 1.609 0 CA-C-N 121.79 1.675 . . . . 0.0 111.537 -1.677 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -63.73 -46.37 85.67 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.922 -177.613 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -142.37 136.22 29.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.274 0.559 . . . . 0.0 110.664 -177.46 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.3 t -150.26 151.33 32.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.454 -177.396 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.461 HG13 HD11 ' A' ' 80' ' ' ILE . 50.1 mt -110.86 139.51 34.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -179.228 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.513 ' CE2' HG21 ' A' ' 17' ' ' ILE . 62.9 t80 -131.83 142.06 49.61 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.81 -176.796 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 60.9 mt -123.82 127.31 73.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.214 0.531 . . . . 0.0 109.813 172.463 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 -94.25 99.54 11.76 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.011 -0.995 . . . . 0.0 109.445 -179.756 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.8 t-20 -74.48 105.75 5.76 Favored 'General case' 0 C--N 1.332 -0.165 0 O-C-N 123.728 0.642 . . . . 0.0 110.951 -175.474 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -71.84 -42.11 67.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.602 -170.879 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.8 mt -73.32 -45.17 56.88 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.781 -173.794 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 52.3 m-20 -95.07 -3.42 48.19 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -175.573 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.1 m 53.04 42.76 32.25 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.493 0.663 . . . . 0.0 111.039 177.095 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.1 m -128.49 132.68 48.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.585 -178.146 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 86.8 p -76.66 130.71 38.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.412 -179.296 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -118.0 122.26 42.74 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 172.965 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.427 HG22 ' HD2' ' A' ' 66' ' ' PHE . 31.4 t -125.55 146.39 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-O 120.745 0.307 . . . . 0.0 110.764 -176.399 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -147.88 126.37 6.09 Favored Pre-proline 0 CA--C 1.539 0.526 0 CA-C-O 118.633 -0.699 . . . . 0.0 110.43 173.836 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -75.47 150.91 36.83 Favored 'Trans proline' 0 N--CA 1.499 1.83 0 C-N-CA 121.453 1.435 . . . . 0.0 112.282 177.682 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.461 HD11 HG13 ' A' ' 65' ' ' ILE . 68.3 mt -93.21 134.64 30.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.229 177.715 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.1 p -132.14 158.06 42.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.702 177.401 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -94.27 34.96 4.4 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.059 -178.567 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.0 t -111.09 -21.15 12.1 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 173.79 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.9 mt -68.61 149.04 49.63 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-O 120.925 0.393 . . . . 0.0 111.379 -176.149 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -115.34 135.87 53.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.682 176.265 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 70.5 mt -114.81 155.21 27.19 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.913 0.387 . . . . 0.0 110.823 -176.963 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -148.7 142.77 25.93 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 178.317 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.6 t -103.52 109.19 20.75 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.645 -0.422 . . . . 0.0 110.919 -179.849 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -106.8 103.81 48.71 Favored Pre-proline 0 C--N 1.329 -0.318 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 171.333 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.09 141.91 49.36 Favored 'Trans proline' 0 N--CA 1.496 1.666 0 CA-C-N 120.477 1.206 . . . . 0.0 111.964 -172.126 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -89.86 11.66 58.31 Favored 'Cis proline' 0 N--CA 1.5 1.853 0 CA-C-N 121.108 1.431 . . . . 0.0 113.629 -3.613 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -90.41 168.25 12.01 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-O 120.62 0.248 . . . . 0.0 110.901 -178.365 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 54.6 tp -118.39 135.02 54.58 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 171.52 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.462 HD11 ' CG2' ' A' ' 102' ' ' ILE . 9.5 tp -126.97 139.15 53.26 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.539 0.209 . . . . 0.0 110.563 -174.487 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -143.13 148.63 36.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.986 0.422 . . . . 0.0 110.178 175.543 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 25.9 mtm180 -103.44 150.56 23.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.135 -175.854 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 24.1 m120 -129.98 162.69 28.09 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.812 0.815 . . . . 0.0 111.221 -179.769 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 51.6 tt0 -49.51 149.55 2.27 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.72 -177.014 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 64.76 30.88 12.17 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.351 -0.841 . . . . 0.0 112.116 -179.834 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 18.2 m 66.64 35.11 5.45 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.958 0.409 . . . . 0.0 111.605 165.652 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 46.9 mtp85 -98.99 143.29 29.45 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.988 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.623 HD13 ' CH2' ' B' 1345 ' ' TRP . 75.9 mt -117.68 126.1 74.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-O 121.181 0.515 . . . . 0.0 110.055 -175.412 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . 0.606 ' CZ ' HG23 ' A' ' 35' ' ' THR . 81.4 mmt-85 -130.95 147.35 52.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.444 178.788 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -139.66 166.42 25.6 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 -178.143 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -125.33 139.8 53.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.878 0.371 . . . . 0.0 110.516 -179.741 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 15.5 t90 -107.49 124.81 50.44 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.464 174.314 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.407 ' CD2' HG22 ' A' ' 31' ' ' VAL . 55.8 m-85 -113.84 143.34 44.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.785 0.326 . . . . 0.0 110.667 -179.481 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -51.24 -35.96 39.47 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.618 178.232 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.5 t-20 -136.04 134.4 38.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.371 179.39 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.0 t -60.79 -41.42 95.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.012 -177.654 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -59.82 -43.21 94.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.315 0.578 . . . . 0.0 110.194 178.881 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -56.78 -45.32 82.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.511 0.672 . . . . 0.0 109.966 179.05 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 42.2 t -59.94 -39.04 84.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.711 178.351 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -59.31 -45.98 89.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.914 0.388 . . . . 0.0 110.577 -177.303 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 60.4 ttm-85 -59.36 -48.45 81.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.998 0.428 . . . . 0.0 110.523 -177.923 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 116' ' ' ILE . . . . . 0.689 HG23 HD11 ' A' ' 54' ' ' ILE . 30.8 mm -58.23 -45.97 88.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.058 -178.709 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 60.3 p -59.28 -43.07 92.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.665 -177.37 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.79 -44.37 94.25 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.654 -0.978 . . . . 0.0 110.654 -178.879 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.499 HD13 ' HB2' ' A' ' 26' ' ' ASP . 10.8 mt -58.4 -49.39 77.43 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.162 0.506 . . . . 0.0 110.528 -178.428 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 52.6 t -59.12 -42.63 87.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.13 -178.597 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 121' ' ' ASN . . . . . 0.405 ' HA ' HD12 ' A' ' 124' ' ' LEU . 87.4 m-20 -57.68 -41.96 82.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.795 0.331 . . . . 0.0 110.594 -178.95 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -60.84 -45.79 95.8 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.954 -0.859 . . . . 0.0 110.954 -179.806 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 58.6 mt -58.68 -42.28 88.17 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.901 0.381 . . . . 0.0 110.548 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.405 HD12 ' HA ' ' A' ' 121' ' ' ASN . 59.1 mt . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.796 -179.38 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B 1338 ' ' LEU . . . . . 0.457 HD12 ' CB ' ' A' ' 43' ' ' TRP . 13.1 mt . . . . . 0 C--O 1.233 0.235 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -79.01 139.75 15.44 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 121.172 1.248 . . . . 0.0 111.343 174.986 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -97.08 125.97 44.01 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-O 118.451 -0.785 . . . . 0.0 109.886 179.901 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -78.13 161.88 29.11 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 121.258 1.305 . . . . 0.0 111.868 176.177 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -50.86 150.01 13.54 Favored 'Trans proline' 0 N--CA 1.494 1.524 0 C-N-CA 121.293 1.329 . . . . 0.0 111.642 177.811 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 81.0 mt -49.91 -28.36 6.56 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -176.611 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 68.3 t80 -55.37 -38.39 68.76 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.859 0.361 . . . . 0.0 111.173 -176.923 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B 1345 ' ' TRP . . . . . 0.623 ' CH2' HD13 ' A' ' 102' ' ' ILE . 9.2 t90 -60.6 -48.06 83.46 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.301 -176.57 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -64.0 -48.5 76.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.898 0.38 . . . . 0.0 110.863 -176.983 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.36 -45.47 91.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.87 -176.326 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -59.75 -47.33 86.1 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.612 -176.424 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.12 -46.93 87.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.032 0.444 . . . . 0.0 110.753 -177.436 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.286 -176.284 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.326 0 N-CA-C 109.557 -1.417 . . . . 15.46 109.557 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -49.17 143.84 18.06 Favored 'Trans proline' 0 N--CA 1.495 1.593 0 C-N-CA 121.374 1.383 . . . . 14.57 112.041 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -137.4 138.95 40.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.11 -0.496 . . . . 17.96 110.589 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 64.8 mtt -102.89 142.87 33.28 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 13.7 110.553 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -68.04 150.48 48.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 10.3 110.589 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -71.73 127.48 32.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 7.47 110.559 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . 0.515 HD12 ' N ' ' A' ' 0' ' ' LEU . 6.4 mp -69.61 -37.92 77.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.193 -0.458 . . . . 8.19 111.097 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.3 mtt -78.33 138.9 38.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.814 0.34 . . . . 5.58 110.774 -178.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -103.3 152.64 21.31 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.129 -0.487 . . . . 2.98 110.524 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.94 141.32 55.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.141 -0.481 . . . . 2.25 110.717 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -62.67 -33.44 75.07 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 2.69 111.593 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 90.7 p -56.32 -40.05 73.76 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.898 0.38 . . . . 1.49 110.725 -178.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.4 mm -60.07 -46.3 94.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.279 -0.419 . . . . 0.54 110.182 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 36.2 m -58.85 -44.91 91.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.3 -0.409 . . . . 0.44 110.369 -177.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -59.22 -45.24 91.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.096 -0.502 . . . . 3.48 110.594 -178.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 96.9 mmm -58.2 -43.37 87.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.034 0.445 . . . . 1.56 110.417 -178.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.9 m120 -60.03 -49.46 77.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.156 -0.475 . . . . 1.04 110.202 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.747 ' HA ' HD12 ' A' ' 14' ' ' ILE . 14.4 tp -61.49 -30.07 70.38 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.593 -0.443 . . . . 0.26 111.368 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.05 -50.45 70.6 Favored 'General case' 0 C--N 1.333 -0.142 0 O-C-N 122.281 -0.262 . . . . 0.26 110.551 177.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.94 -42.01 84.01 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.078 0.466 . . . . 0.2 110.373 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.747 HD12 ' HA ' ' A' ' 11' ' ' LEU . 97.6 mt -54.05 -53.08 30.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.692 -0.685 . . . . 0.2 110.66 178.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 54.2 mttm -53.1 -26.46 16.51 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.551 0.574 . . . . 1.46 112.551 -178.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -59.49 -33.18 71.01 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 111.904 0.335 . . . . 3.34 111.904 -177.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 48.8 mm -104.48 -44.3 8.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.047 0.451 . . . . 0.32 110.089 -177.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -114.7 85.43 11.42 Favored Pre-proline 0 CA--C 1.534 0.338 0 CA-C-N 115.707 -0.679 . . . . 0.32 110.236 -176.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.07 -21.68 13.1 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 C-N-CA 121.399 1.399 . . . . 0.59 113.42 -176.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.0 p90 -100.01 17.2 21.62 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.347 0.869 . . . . 1.35 113.347 -174.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.408 ' HB3' HG22 ' A' ' 14' ' ' ILE . . . -94.31 118.97 32.38 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 109.09 -0.707 . . . . 0.35 109.09 173.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.488 ' O ' HD21 ' A' ' 11' ' ' LEU . 76.4 tttt -108.8 -37.78 5.79 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 120.835 -0.346 . . . . 2.95 111.513 -172.084 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -128.33 147.96 50.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.873 0.368 . . . . 1.78 110.979 -176.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.506 HG13 HD13 ' A' ' 11' ' ' LEU . 58.7 mt -102.98 131.77 50.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.009 -0.542 . . . . 0.25 109.926 173.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.8 t -92.1 -47.22 14.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.916 0.389 . . . . 0.16 110.031 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -155.9 156.17 34.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.028 -0.533 . . . . 0.13 110.059 178.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 59.7 p -142.5 132.0 23.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.936 0.398 . . . . 0.15 110.58 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.2 t -106.52 129.72 54.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.925 -0.579 . . . . 0.19 109.797 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 30.2 m -54.2 -38.7 65.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.715 -0.675 . . . . 1.31 111.251 -172.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -152.72 127.8 9.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.178 0.513 . . . . 0.3 111.598 -178.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.404 HG21 ' HB3' ' A' ' 52' ' ' PHE . 99.3 t -145.19 143.85 21.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.004 -0.998 . . . . 0.09 109.539 -177.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -131.15 149.82 52.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.562 -0.29 . . . . 0.13 111.094 -178.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -99.2 131.48 45.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.277 0.56 . . . . 1.47 111.507 -177.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -127.44 143.91 51.13 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 115.946 -0.57 . . . . 0.35 110.823 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 86.4 m -121.89 148.56 44.58 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.24 -0.652 . . . . 0.25 109.24 177.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -109.45 131.95 54.59 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.999 0.428 . . . . 1.11 110.441 176.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 -103.78 114.17 28.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.878 -0.601 . . . . 0.44 109.718 176.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 86.6 p -68.92 -30.3 68.73 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.903 -0.59 . . . . 1.36 112.196 -176.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.8 p -62.4 -39.17 92.37 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.686 0.279 . . . . 1.47 110.932 -177.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -94.5 -21.51 18.84 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.607 0.595 . . . . 2.0 112.607 -179.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 69.82 44.49 0.84 Allowed 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 121.414 0.626 . . . . 1.3 109.652 -177.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -149.87 160.87 43.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.614 -0.721 . . . . 1.93 111.09 -177.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 80.7 m95 -94.66 140.76 29.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.085 -0.507 . . . . 0.3 110.379 177.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -122.87 129.08 51.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.274 -0.421 . . . . 2.3 110.039 177.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 72.9 tttt -76.84 140.39 40.63 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.948 -0.39 . . . . 2.6 109.948 178.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.1 p -92.34 176.0 6.64 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.723 -0.391 . . . . 0.32 110.131 -179.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -86.17 12.94 8.66 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.638 0.607 . . . . 2.17 112.638 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.8 t -106.94 106.42 20.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-O 120.916 0.389 . . . . 0.33 110.381 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -130.39 113.02 13.82 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.575 -0.898 . . . . 0.29 108.575 174.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.66 176.48 38.97 Favored Glycine 0 CA--C 1.52 0.376 0 C-N-CA 120.191 -1.004 . . . . 0.1 112.361 -168.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.461 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -79.37 136.15 36.91 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.9 -0.778 . . . . 0.09 108.9 174.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.404 ' HB3' HG21 ' A' ' 31' ' ' VAL . 4.9 t80 -101.94 127.23 48.87 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.96 -0.296 . . . . 0.1 110.388 -175.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.461 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 6.3 m-85 -130.61 142.19 50.45 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.785 0.326 . . . . 0.11 110.647 177.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.657 HD11 HG23 ' A' ' 116' ' ' ILE . 68.1 mt -101.55 127.1 55.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.241 -0.652 . . . . 0.16 109.241 171.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.688 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 13.8 m-30 -108.58 138.17 45.32 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.015 0.436 . . . . 0.21 111.285 -177.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 68.2 t60 -111.5 143.38 42.45 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.359 -0.837 . . . . 0.26 110.213 175.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 71.6 ttt180 -139.51 147.11 40.81 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.873 -0.603 . . . . 2.62 110.002 178.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -86.92 28.13 0.93 Allowed 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.15 -0.477 . . . . 1.26 112.136 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.52 160.79 38.57 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.735 -0.468 . . . . 0.36 109.735 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -63.98 131.16 94.87 Favored Pre-proline 0 CA--C 1.54 0.581 0 CA-C-O 118.483 -0.77 . . . . 2.53 110.059 -176.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -71.79 140.86 67.96 Favored 'Cis proline' 0 N--CA 1.498 1.752 0 CA-C-N 121.734 1.655 . . . . 0.63 111.58 -1.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -63.95 -40.43 96.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.278 -0.419 . . . . 1.34 111.079 -177.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.472 ' HB3' HD12 ' A' ' 80' ' ' ILE . 77.7 m80 -142.65 141.35 31.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.589 0.709 . . . . 0.3 111.044 -176.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.3 t -149.19 151.55 34.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.595 -0.729 . . . . 0.19 110.02 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.419 HG13 HD11 ' A' ' 80' ' ' ILE . 57.0 mt -115.62 138.98 44.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.43 . . . . 0.2 109.883 -177.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -131.85 142.14 49.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.787 -0.642 . . . . 1.27 111.1 -177.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.4 mt -120.33 128.99 76.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-O 121.235 0.54 . . . . 0.16 109.578 171.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -94.73 99.5 11.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.022 -0.99 . . . . 0.11 109.191 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.3 t-20 -72.53 105.84 4.36 Favored 'General case' 0 C--N 1.333 -0.138 0 O-C-N 123.65 0.594 . . . . 0.19 111.031 -174.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -73.87 -40.96 62.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.836 -0.62 . . . . 3.41 111.252 -171.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 70.9 mt -70.81 -45.23 64.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.359 -0.382 . . . . 0.29 111.644 -175.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 62.3 m-20 -95.06 -3.33 48.41 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 113.761 1.023 . . . . 1.89 113.761 -175.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.438 ' O ' HG22 ' A' ' 73' ' ' THR . 14.5 m 55.88 43.41 27.57 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-O 121.521 0.677 . . . . 1.18 110.49 177.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 34.5 m -127.45 148.87 50.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.441 -0.799 . . . . 0.39 110.618 -178.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.1 p -100.82 131.95 46.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.09 -0.505 . . . . 0.61 110.88 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -128.57 122.18 30.44 Favored 'General case' 0 N--CA 1.462 0.175 0 N-CA-C 110.204 -0.295 . . . . 1.38 110.204 175.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 p -125.57 149.95 30.59 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 116.358 -0.383 . . . . 1.25 111.004 -177.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -149.35 136.86 11.26 Favored Pre-proline 0 CA--C 1.538 0.488 0 CA-C-O 119.053 -0.499 . . . . 1.81 110.755 174.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.39 150.91 37.19 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 121.691 1.594 . . . . 0.28 112.378 178.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.472 HD12 ' HB3' ' A' ' 63' ' ' HIS . 64.4 mt -89.39 123.76 41.77 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 C-N-CA 120.657 -0.417 . . . . 0.25 110.47 178.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 40.4 p -99.35 159.02 15.31 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.073 -0.512 . . . . 0.55 110.065 175.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -98.41 7.75 61.94 Favored Glycine 0 CA--C 1.534 1.231 0 C-N-CA 120.97 -0.633 . . . . 0.5 113.597 -178.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.8 p -98.76 -5.31 31.56 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 117.947 0.873 . . . . 1.31 112.932 177.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.5 mt -68.99 141.18 54.98 Favored 'General case' 0 C--O 1.232 0.143 0 O-C-N 122.062 -0.398 . . . . 0.89 111.47 -177.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 57.2 tt0 -112.08 135.83 52.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.086 -0.507 . . . . 0.66 109.638 175.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.478 HD12 ' ND2' ' A' ' 121' ' ' ASN . 69.4 mt -113.84 158.38 21.1 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.03 0.443 . . . . 0.26 111.25 -175.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -148.71 145.68 27.78 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.814 -0.81 . . . . 0.66 108.814 176.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.1 t -114.63 109.3 18.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.009 0.433 . . . . 0.3 111.433 -177.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -106.82 103.54 47.61 Favored Pre-proline 0 CA--C 1.532 0.262 0 N-CA-C 108.672 -0.862 . . . . 1.29 108.672 169.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 91' ' ' PRO . 23.2 Cg_endo -62.08 141.86 90.29 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 CA-C-N 120.593 1.248 . . . . 0.51 111.457 -171.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 90' ' ' PRO . 89.4 Cg_endo -95.38 14.48 41.32 Favored 'Cis proline' 0 N--CA 1.497 1.724 0 CA-C-N 121.143 1.444 . . . . 0.45 113.649 -3.245 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -107.45 136.64 46.9 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 122.525 -0.11 . . . . 1.29 110.896 -175.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.464 HD22 ' OG ' ' A' ' 117' ' ' SER . 36.5 tp -92.93 136.58 33.12 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 120.503 -0.479 . . . . 0.23 110.63 -176.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.5 HD11 ' CG2' ' A' ' 102' ' ' ILE . 8.7 tp -124.02 139.64 53.75 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.068 -0.515 . . . . 0.26 110.324 -173.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.1 p90 -143.96 153.95 42.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.822 0.344 . . . . 1.23 110.586 176.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 27.0 mtm105 -101.98 146.82 27.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.103 -0.499 . . . . 1.56 110.606 -178.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 16.5 t30 -129.97 168.43 16.69 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.667 0.746 . . . . 1.66 111.552 -177.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -47.08 145.8 2.01 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.566 -0.743 . . . . 2.32 112.233 -176.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 60.3 mtp180 63.82 30.91 14.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.168 -0.924 . . . . 3.51 112.146 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.2 m 65.19 35.12 8.01 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.949 0.404 . . . . 1.3 111.524 167.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 36.2 mtp180 -98.28 151.98 19.91 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.307 -0.627 . . . . 2.68 109.307 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.669 HD13 ' CH2' ' B' 1345 ' ' TRP . 72.3 mt -117.12 127.52 74.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 121.153 0.502 . . . . 0.23 110.068 -176.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 81.0 mtt85 -138.41 150.33 46.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.66 -0.7 . . . . 1.75 109.495 178.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.7 168.77 26.26 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 120.787 -0.72 . . . . 0.2 111.81 -176.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -125.27 135.02 52.1 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.279 -0.46 . . . . 1.45 110.269 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 46.5 t90 -107.46 131.01 54.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.012 -0.54 . . . . 0.78 109.899 177.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -117.17 149.77 39.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.792 0.329 . . . . 1.18 110.602 -179.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -52.63 -37.71 58.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.137 -0.483 . . . . 1.21 111.441 176.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.5 t-20 -131.28 135.2 47.1 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.467 -0.333 . . . . 0.33 110.53 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.7 t -61.97 -41.99 98.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.271 -0.422 . . . . 1.38 111.084 -177.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -60.03 -43.68 95.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.432 0.634 . . . . 0.97 110.096 179.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 48.5 tt0 -56.43 -44.59 80.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.635 -0.711 . . . . 0.14 109.996 178.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 38.0 t -59.83 -38.5 82.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.494 -0.775 . . . . 0.24 110.732 177.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -59.11 -46.32 88.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.917 0.389 . . . . 1.63 110.527 -177.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 -59.54 -49.17 78.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.141 0.496 . . . . 3.38 110.599 -177.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.657 HG23 HD11 ' A' ' 54' ' ' ILE . 27.5 mm -58.49 -46.51 89.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.42 0.629 . . . . 0.13 109.973 -178.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.464 ' OG ' HD22 ' A' ' 93' ' ' LEU . 20.9 m -58.65 -40.9 84.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.97 -0.559 . . . . 0.76 110.682 -177.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -56.9 -42.43 92.34 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 110.688 -0.965 . . . . 0.18 110.688 -179.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.545 HD12 ' HA ' ' A' ' 116' ' ' ILE . 16.0 mt -57.79 -50.05 74.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.438 0.637 . . . . 0.18 110.275 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 53.1 t -58.46 -43.62 87.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.546 -0.752 . . . . 0.23 110.109 -177.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.478 ' ND2' HD12 ' A' ' 86' ' ' LEU . 24.4 m120 -57.45 -41.51 80.65 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.3 -0.409 . . . . 1.04 110.634 -178.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.43 -45.63 95.5 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 111.184 -0.766 . . . . 0.29 111.184 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 66.8 mt -57.89 -41.7 83.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.899 0.38 . . . . 0.33 110.621 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 88.5 mt -59.64 -40.57 88.1 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.007 -0.542 . . . . 0.55 110.749 -179.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 16.7 pttp -93.95 -3.32 51.77 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 113.392 0.886 . . . . 1.36 113.392 -178.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 24.4 t -131.09 135.22 47.33 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 118.127 0.421 . . . . 1.56 110.622 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 56.3 tttp . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 117.989 -1.005 . . . . 3.52 110.628 -179.969 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.346 0 N-CA-C 109.53 -1.428 . . . . 25.24 109.53 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -49.57 140.91 27.6 Favored 'Trans proline' 0 N--CA 1.496 1.629 0 C-N-CA 121.31 1.34 . . . . 24.41 112.005 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 57.7 tp60 -100.16 125.56 46.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.244 -0.434 . . . . 21.25 110.506 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -67.86 153.41 95.24 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.278 -0.419 . . . . 19.71 110.532 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -78.82 140.31 16.22 Favored 'Trans proline' 0 N--CA 1.493 1.493 0 C-N-CA 121.396 1.397 . . . . 18.02 112.038 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1323 ' ' LEU . . . . . 0.517 ' H ' HD12 ' B' 1323 ' ' LEU . 6.4 mp -63.08 -41.49 99.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.176 -0.465 . . . . 17.84 110.607 179.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.5 mt -108.96 136.71 48.05 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.245 -0.434 . . . . 15.4 110.391 179.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -124.48 134.19 53.12 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.325 -0.398 . . . . 13.63 110.547 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -89.8 -58.49 2.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.18 -0.464 . . . . 17.12 110.361 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -129.23 156.51 43.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.118 -0.492 . . . . 13.41 110.263 179.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -72.92 111.87 8.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 9.79 110.511 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.65 155.95 39.67 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.178 -0.464 . . . . 7.76 110.567 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -74.65 140.72 26.85 Favored 'Trans proline' 0 N--CA 1.494 1.521 0 C-N-CA 121.301 1.334 . . . . 6.7 111.945 178.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 12.1 t80 -133.83 99.88 13.68 Favored Pre-proline 0 CA--C 1.534 0.335 0 CA-C-O 119.076 -0.487 . . . . 5.8 110.392 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -59.34 128.91 29.09 Favored 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 121.066 1.177 . . . . 3.82 111.586 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 100.25 -5.17 57.37 Favored Glycine 0 CA--C 1.534 1.267 0 CA-C-N 116.026 -0.534 . . . . 2.87 113.466 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -88.49 120.72 30.13 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 118.204 1.002 . . . . 3.0 110.459 178.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 7.2 ttt -78.39 140.42 60.43 Favored Pre-proline 0 CA--C 1.533 0.32 0 CA-C-O 118.947 -0.549 . . . . 1.11 110.004 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -71.66 151.51 58.19 Favored 'Trans proline' 0 N--CA 1.496 1.656 0 C-N-CA 121.232 1.288 . . . . 1.01 111.639 176.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 25.8 m120 -101.16 110.43 22.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.841 0.353 . . . . 2.57 110.746 -178.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 8.4 mt -69.91 151.23 96.29 Favored Pre-proline 0 C--N 1.33 -0.262 0 N-CA-C 109.59 -0.522 . . . . 0.51 109.59 177.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -79.06 139.79 15.37 Favored 'Trans proline' 0 N--CA 1.492 1.386 0 C-N-CA 121.057 1.171 . . . . 0.6 111.08 174.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -97.17 125.78 44.54 Favored Pre-proline 0 CA--C 1.535 0.391 0 CA-C-O 118.512 -0.756 . . . . 2.42 109.955 179.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -78.18 169.04 20.9 Favored 'Trans proline' 0 N--CA 1.497 1.721 0 C-N-CA 121.311 1.34 . . . . 0.7 112.015 176.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -65.18 157.08 59.46 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 121.328 1.352 . . . . 0.67 111.396 176.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 9.8 tt -50.0 -32.82 16.14 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.131 0.419 . . . . 1.84 112.131 -176.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 58.4 t80 -54.28 -36.16 63.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.85 0.357 . . . . 3.35 111.418 -176.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1345 ' ' TRP . . . . . 0.669 ' CH2' HD13 ' A' ' 102' ' ' ILE . 12.1 t90 -61.75 -48.18 81.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.37 -0.377 . . . . 0.37 110.448 -176.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -62.45 -47.93 81.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.042 0.449 . . . . 1.82 110.574 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -59.45 -44.49 92.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.142 -0.481 . . . . 2.4 110.905 -177.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -59.03 -46.39 88.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.249 -0.432 . . . . 1.53 110.654 -176.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.53 -48.0 83.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.113 0.482 . . . . 0.43 110.631 -177.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.11 -42.23 90.04 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.974 -0.557 . . . . 2.09 111.141 -176.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -64.42 -47.97 77.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.198 -0.455 . . . . 3.34 111.05 -177.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -55.01 -45.91 75.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.303 -0.408 . . . . 2.23 111.17 -178.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 43.0 tp10 -65.0 -36.99 86.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.374 -0.375 . . . . 1.84 111.054 178.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -76.26 147.97 37.92 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.801 0.334 . . . . 1.64 110.526 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 13.1 tp . . . . . 0 C--O 1.221 -0.421 0 CA-C-O 118.007 -0.997 . . . . 3.76 110.497 179.943 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.318 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.72 -31.38 49.16 Favored 'Trans proline' 0 N--CA 1.496 1.619 0 C-N-CA 121.319 1.346 . . . . 0.0 112.212 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 75.5 m80 -131.3 162.8 29.23 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.487 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 86.0 mtp -115.17 162.97 16.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.457 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -57.84 141.5 48.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.556 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -84.14 120.56 26.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.442 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 29.4 tp -56.53 -39.97 74.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.896 -179.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.0 mmm -93.79 127.73 39.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.481 -179.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.72 149.52 21.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.565 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -97.36 105.96 18.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.559 179.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -66.76 -35.74 80.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.321 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.6 p -56.87 -40.69 76.63 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.89 0.376 . . . . 0.0 110.721 -177.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mm -60.39 -47.18 93.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.0 0.429 . . . . 0.0 110.211 -178.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.6 m -58.94 -43.88 91.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.565 -177.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.0 mtp85 -59.75 -44.95 93.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.626 -178.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 97.2 mmm -58.24 -43.92 88.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.005 0.431 . . . . 0.0 110.425 -178.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -60.7 -49.69 76.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.271 -178.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.657 ' HA ' HD12 ' A' ' 14' ' ' ILE . 10.6 tp -59.33 -32.9 70.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.05 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.69 -50.68 68.26 Favored 'General case' 0 C--N 1.332 -0.166 0 O-C-N 122.294 -0.254 . . . . 0.0 110.906 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.75 -41.71 82.45 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.99 0.424 . . . . 0.0 110.502 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.657 HD12 ' HA ' ' A' ' 11' ' ' LEU . 94.9 mt -54.18 -53.07 31.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.715 177.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -52.88 -21.34 4.16 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -57.91 -35.4 71.01 Favored 'General case' 0 C--N 1.332 -0.169 0 O-C-N 122.33 -0.231 . . . . 0.0 111.477 -177.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.656 HG21 ' HB2' ' A' ' 75' ' ' SER . 45.8 mm -113.01 -39.78 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-O 120.776 0.322 . . . . 0.0 110.554 -177.202 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -117.29 77.2 9.65 Favored Pre-proline 0 CA--C 1.535 0.367 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.162 -178.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -55.69 -21.49 32.13 Favored 'Trans proline' 0 N--CA 1.498 1.738 0 C-N-CA 121.512 1.475 . . . . 0.0 113.396 -175.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -88.69 8.76 27.04 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -174.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -86.81 124.77 33.42 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 174.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.594 ' O ' HD21 ' A' ' 11' ' ' LEU . 67.7 mttm -105.61 -39.35 6.12 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.798 0.332 . . . . 0.0 111.173 -174.025 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -134.72 144.78 47.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.97 0.414 . . . . 0.0 111.064 -176.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.405 HD11 HD12 ' A' ' 14' ' ' ILE . 24.4 mt -96.34 131.32 43.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 172.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.1 t -91.49 -47.19 14.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 0.0 109.929 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.492 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -153.03 152.01 30.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.844 178.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.9 p -139.86 131.94 27.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.083 0.468 . . . . 0.0 110.958 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 45.0 t -105.37 126.9 52.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.654 176.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.1 m -54.4 -38.9 66.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.191 -172.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -151.31 127.04 10.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.217 0.532 . . . . 0.0 111.501 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.464 HG22 ' CD2' ' A' ' 107' ' ' PHE . 96.5 t -144.91 142.31 22.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.008 -0.996 . . . . 0.0 109.526 -177.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -131.53 149.87 52.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.203 -178.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.438 ' HD2' HG21 ' A' ' 46' ' ' THR . 20.5 t80 -100.68 131.33 46.64 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.656 -176.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 45.1 m-85 -127.16 144.45 51.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.819 178.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 74.7 m -122.46 149.48 43.81 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 177.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -109.48 131.93 54.61 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.854 0.359 . . . . 0.0 110.316 175.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.0 t-20 -103.92 114.7 29.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.73 176.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 84.8 p -68.6 -31.41 70.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.058 -177.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.2 m -61.91 -38.61 89.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.686 0.279 . . . . 0.0 110.964 -177.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -95.1 -21.44 18.54 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -178.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 51.0 t30 68.95 45.65 0.92 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-O 121.411 0.624 . . . . 0.0 109.343 -177.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 76.8 tt0 -151.49 150.58 30.54 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.281 -176.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 78.2 m95 -85.32 138.46 32.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.459 . . . . 0.0 109.871 175.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -122.05 126.39 48.37 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 177.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -73.8 139.71 45.35 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 177.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.438 HG21 ' HD2' ' A' ' 33' ' ' PHE . 69.7 p -92.31 175.42 6.85 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.181 -178.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.6 p30 -86.51 13.71 7.98 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.1 t -108.5 106.42 20.66 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-O 121.047 0.451 . . . . 0.0 110.342 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -131.49 112.1 12.36 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 174.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.64 176.56 38.95 Favored Glycine 0 CA--C 1.522 0.48 0 C-N-CA 120.125 -1.036 . . . . 0.0 112.283 -168.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.491 ' HB2' HH21 ' A' ' 70' ' ' ARG . . . -77.47 135.85 38.3 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 174.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -103.04 126.96 50.45 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.368 -175.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.475 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 5.0 m-85 -130.04 142.07 50.66 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.744 0.307 . . . . 0.0 110.72 177.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.59 HD11 HG23 ' A' ' 116' ' ' ILE . 68.3 mt -101.59 126.9 55.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 171.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.62 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 14.2 m-30 -108.65 138.56 44.77 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.995 0.426 . . . . 0.0 111.552 -177.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -108.82 143.34 38.13 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.976 173.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -140.49 146.34 38.05 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.111 178.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -86.88 28.11 0.93 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 112.1 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.97 162.77 38.22 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -63.91 129.88 94.13 Favored Pre-proline 0 CA--C 1.539 0.528 0 CA-C-O 118.448 -0.787 . . . . 0.0 110.002 -177.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -73.46 140.93 70.01 Favored 'Cis proline' 0 N--CA 1.498 1.793 0 CA-C-N 121.867 1.703 . . . . 0.0 111.681 -1.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -63.09 -40.73 98.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.925 -177.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.475 ' HB3' HD12 ' A' ' 80' ' ' ILE . 77.9 m80 -143.02 140.51 31.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.401 0.619 . . . . 0.0 110.944 -177.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.5 t -149.81 152.31 34.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.281 -178.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.428 HG13 HD11 ' A' ' 80' ' ' ILE . 53.1 mt -116.13 138.65 45.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 -177.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -131.87 142.09 49.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.135 -176.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.6 mt -121.05 131.47 72.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.186 0.517 . . . . 0.0 109.833 172.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -98.71 99.56 10.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.902 -1.044 . . . . 0.0 109.335 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.4 t-20 -73.2 107.71 5.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.271 0.558 . . . . 0.0 111.268 -174.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.491 HH21 ' HB2' ' A' ' 51' ' ' ALA . 96.8 mtt180 -73.47 -39.38 64.97 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.272 -172.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 70.2 mt -73.23 -45.19 57.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.719 -174.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -95.05 -3.42 48.27 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.753 1.019 . . . . 0.0 113.753 -175.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.8 m 55.95 43.14 27.82 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 121.477 0.656 . . . . 0.0 110.49 177.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.8 m -130.13 149.02 52.03 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.332 -178.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.656 ' HB2' HG21 ' A' ' 17' ' ' ILE . 4.0 p -102.66 139.98 37.54 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.094 -179.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -134.64 122.25 22.01 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.185 177.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.7 p -125.55 148.49 30.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.038 -177.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 55.5 tt0 -148.66 137.07 11.62 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-O 119.063 -0.494 . . . . 0.0 110.622 175.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.53 150.95 36.63 Favored 'Trans proline' 0 N--CA 1.498 1.744 0 C-N-CA 121.67 1.58 . . . . 0.0 112.268 178.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.475 HD12 ' HB3' ' A' ' 63' ' ' HIS . 63.4 mt -89.42 121.07 39.15 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 C-N-CA 120.711 -0.395 . . . . 0.0 110.363 178.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 71.0 p -99.1 160.8 14.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.052 176.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -97.38 7.31 63.83 Favored Glycine 0 CA--C 1.533 1.215 0 C-N-CA 120.877 -0.678 . . . . 0.0 113.607 -178.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.7 p -99.04 -3.75 34.04 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 117.927 0.863 . . . . 0.0 113.015 177.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.0 mt -68.36 144.45 54.77 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 118.1 0.409 . . . . 0.0 111.166 -177.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.1 tt0 -115.97 135.84 53.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.78 176.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.403 HD12 ' OD1' ' A' ' 121' ' ' ASN . 60.0 mt -117.23 157.74 25.51 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.896 0.379 . . . . 0.0 110.854 -176.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -150.14 143.36 25.0 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.0 t -98.59 109.11 21.92 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.491 178.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.4 ' HG3' HD22 ' A' ' 94' ' ' LEU . 20.9 mm-40 -106.87 103.75 48.64 Favored Pre-proline 0 C--N 1.328 -0.329 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 172.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -70.4 143.11 46.82 Favored 'Trans proline' 0 N--CA 1.497 1.702 0 CA-C-N 120.541 1.229 . . . . 0.0 112.027 -171.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -90.94 14.59 50.13 Favored 'Cis proline' 0 N--CA 1.5 1.858 0 CA-C-N 121.041 1.407 . . . . 0.0 113.481 -3.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -95.97 172.28 8.1 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.531 0.205 . . . . 0.0 110.627 -177.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.8 tp -113.98 135.01 54.46 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 172.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.402 HD21 ' HZ2' ' B' 1345 ' ' TRP . 9.0 tp -126.02 139.19 53.62 Favored 'General case' 0 C--N 1.333 -0.114 0 N-CA-C 110.428 -0.212 . . . . 0.0 110.428 -173.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 50.8 p90 -145.97 154.43 41.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.965 0.412 . . . . 0.0 110.627 174.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.6 mtm180 -104.75 149.13 25.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.729 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -129.96 165.56 21.87 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.856 0.836 . . . . 0.0 111.549 -178.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -48.45 146.54 2.86 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.524 -0.762 . . . . 0.0 112.1 -176.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 38.8 ttp180 65.23 30.95 11.08 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.289 -0.869 . . . . 0.0 112.041 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 46.9 t 66.05 35.23 6.43 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.858 0.361 . . . . 0.0 111.538 166.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 18.7 mmm180 -97.89 148.24 23.63 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 76.9 mt -113.66 128.55 70.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -178.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 -138.75 150.31 45.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.535 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.33 169.32 25.89 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 111.494 -0.642 . . . . 0.0 111.494 -175.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -125.19 139.87 53.36 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-O 120.951 0.405 . . . . 0.0 110.909 -177.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 65.5 t90 -106.22 125.39 50.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.533 174.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.464 ' CD2' HG22 ' A' ' 31' ' ' VAL . 67.7 m-85 -117.19 140.31 49.69 Favored 'General case' 0 C--N 1.33 -0.258 0 O-C-N 123.262 0.351 . . . . 0.0 110.539 -179.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -50.49 -39.71 49.17 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.908 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -131.72 137.26 48.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.664 0.268 . . . . 0.0 110.372 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 84.3 p -62.28 -42.28 99.21 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.144 -177.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -59.01 -44.19 91.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.431 0.634 . . . . 0.0 109.961 178.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -55.94 -44.22 78.18 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.152 178.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 49.2 t -60.07 -40.65 90.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.594 178.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -59.09 -46.1 89.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.904 0.383 . . . . 0.0 110.634 -176.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.0 mtm180 -61.04 -49.38 77.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.817 -177.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.59 HG23 HD11 ' A' ' 54' ' ' ILE . 26.8 mm -58.65 -44.3 89.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.996 0.427 . . . . 0.0 109.963 -178.433 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.8 m -59.36 -44.19 92.74 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.667 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.59 -44.36 93.92 Favored Glycine 0 CA--C 1.523 0.582 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 -178.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.492 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.2 mt -59.03 -49.09 79.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.145 0.498 . . . . 0.0 110.607 -178.37 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 56.9 t -58.97 -42.66 86.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.164 -178.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.403 ' OD1' HD12 ' A' ' 86' ' ' LEU . 83.6 m-20 -57.74 -42.75 84.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.881 0.372 . . . . 0.0 110.552 -178.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.65 -42.28 99.73 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 -179.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.4 mt -62.69 -43.12 99.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.774 0.321 . . . . 0.0 111.105 179.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 65.4 mt -63.81 -44.91 91.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.458 -176.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 26.6 pttt -71.5 -35.41 70.75 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.508 -177.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 29.0 t -86.48 141.48 29.06 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.758 0.313 . . . . 0.0 110.533 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 65.1 tttm . . . . . 0 C--O 1.221 -0.435 0 CA-C-O 118.045 -0.979 . . . . 0.0 110.572 -179.832 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.35 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -50.76 140.33 37.91 Favored 'Trans proline' 0 N--CA 1.495 1.562 0 C-N-CA 121.294 1.329 . . . . 0.0 112.012 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -115.51 148.58 39.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.493 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -68.29 154.28 94.36 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.537 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.16 -31.16 36.86 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 121.25 1.3 . . . . 0.0 112.259 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 28.8 tp -56.51 -39.8 73.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.864 -179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 26.8 tp -97.56 133.5 42.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.729 -179.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 96.8 mm-40 -102.34 145.01 30.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.451 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -59.39 -41.34 89.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.662 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -104.02 138.45 40.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.435 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 60.6 ttm-85 -74.87 123.64 25.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.559 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.62 164.69 14.17 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.535 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -49.5 150.71 8.06 Favored 'Trans proline' 0 N--CA 1.496 1.63 0 C-N-CA 121.339 1.359 . . . . 0.0 111.943 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -60.9 150.79 76.25 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.382 -179.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -57.82 128.92 30.93 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 121.134 1.222 . . . . 0.0 111.878 -178.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 96.7 -5.08 64.08 Favored Glycine 0 CA--C 1.534 1.23 0 CA-C-O 119.651 -0.527 . . . . 0.0 113.594 177.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -106.94 117.91 35.31 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 118.278 1.039 . . . . 0.0 110.587 178.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 6.3 ttp -93.08 143.3 26.55 Favored Pre-proline 0 CA--C 1.533 0.307 0 CA-C-O 118.992 -0.528 . . . . 0.0 109.953 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -58.46 143.41 97.89 Favored 'Trans proline' 0 N--CA 1.497 1.718 0 C-N-CA 121.169 1.246 . . . . 0.0 111.757 177.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 8.1 p30 -99.46 117.55 34.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.679 -179.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 17.7 mt -83.3 151.95 63.64 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.312 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.17 139.87 15.25 Favored 'Trans proline' 0 N--CA 1.492 1.437 0 C-N-CA 121.163 1.242 . . . . 0.0 110.981 173.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 49.0 mmtt -97.11 125.76 44.74 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-O 118.892 -0.575 . . . . 0.0 109.982 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -75.8 154.13 38.58 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 121.392 1.394 . . . . 0.0 111.381 171.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -51.68 152.11 13.5 Favored 'Trans proline' 0 N--CA 1.496 1.633 0 C-N-CA 121.271 1.314 . . . . 0.0 111.621 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.3 tp -50.0 -29.74 9.23 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -177.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -55.15 -37.27 66.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.815 0.34 . . . . 0.0 111.223 -177.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1345 ' ' TRP . . . . . 0.402 ' HZ2' HD21 ' A' ' 94' ' ' LEU . 35.5 t90 -60.89 -48.03 83.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.181 -177.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -61.7 -49.44 76.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.088 0.471 . . . . 0.0 110.482 -177.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -59.96 -45.44 92.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.974 -176.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -59.44 -47.33 85.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.713 -175.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.73 -48.56 81.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.823 -176.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -59.54 -44.62 93.17 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.144 -175.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 76.2 mttt -65.37 -47.43 76.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.297 -177.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -55.1 -47.42 74.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.164 -178.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 43.0 tp10 -64.95 -37.01 86.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.078 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -67.74 144.57 55.36 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.792 0.33 . . . . 0.0 110.535 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 29.7 tp . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.53 179.969 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.283 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -68.79 145.39 62.65 Favored 'Trans proline' 0 N--CA 1.495 1.604 0 C-N-CA 121.276 1.317 . . . . 0.0 111.937 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -57.18 -42.86 81.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.721 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 43.3 ttm -105.69 147.52 28.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.529 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -137.36 150.78 47.95 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.47 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -95.59 150.77 19.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.622 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . 0.529 ' H ' HD12 ' A' ' 0' ' ' LEU . 6.3 mp -59.59 -40.13 86.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.821 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.8 mtp -72.05 151.06 43.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.611 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -57.67 145.69 33.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.53 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -138.66 170.05 16.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.637 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -60.67 -36.44 78.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.096 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.2 t -56.71 -41.25 77.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.954 0.407 . . . . 0.0 110.594 -178.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.2 mm -59.87 -46.07 94.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.133 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.2 m -58.84 -44.71 90.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.449 -177.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -59.7 -45.13 93.05 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.66 -178.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 89.6 mtp -58.25 -42.92 87.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.996 0.427 . . . . 0.0 110.416 -178.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -60.13 -49.97 75.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.216 -178.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.75 ' HA ' HD12 ' A' ' 14' ' ' ILE . 14.2 tp -61.31 -30.5 70.54 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.631 -0.427 . . . . 0.0 111.342 -179.566 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.57 -49.78 73.89 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 122.219 -0.301 . . . . 0.0 110.505 178.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.16 -42.32 85.74 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.032 0.444 . . . . 0.0 110.336 178.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.75 HD12 ' HA ' ' A' ' 11' ' ' LEU . 95.6 mt -54.24 -52.98 33.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.755 178.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -55.62 -26.55 44.71 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -177.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 52.8 mttm -59.98 -30.82 69.37 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -177.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.9 mm -107.63 -42.49 6.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.843 0.354 . . . . 0.0 110.319 -176.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -114.7 84.6 10.35 Favored Pre-proline 0 CA--C 1.533 0.315 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.473 -176.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -53.11 -22.95 20.72 Favored 'Trans proline' 0 N--CA 1.496 1.671 0 C-N-CA 121.528 1.486 . . . . 0.0 113.338 -177.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.2 p90 -97.51 22.07 9.39 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 -175.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -107.89 122.4 46.72 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 171.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.476 ' O ' HD21 ' A' ' 11' ' ' LEU . 46.1 mtmt -116.71 -30.14 5.88 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -174.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.8 tt0 -128.84 142.25 51.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.763 0.316 . . . . 0.0 110.862 -178.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.474 HG13 HD13 ' A' ' 11' ' ' LEU . 57.6 mt -98.98 132.42 44.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.85 174.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 43.6 t -94.41 -47.14 13.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.195 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.504 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.1 t0 -154.05 153.76 32.48 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.181 178.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.5 p -141.72 131.99 24.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.943 0.401 . . . . 0.0 110.749 178.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 38.3 t -106.98 129.15 54.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.726 176.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.8 m -54.27 -38.22 65.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.252 -172.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -152.73 126.66 9.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.141 0.496 . . . . 0.0 111.759 -178.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 99.3 t -145.19 142.64 22.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.534 -177.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.93 149.89 50.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.68 -0.236 . . . . 0.0 111.022 -179.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -98.72 132.58 43.99 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.33 0.586 . . . . 0.0 111.602 -177.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -129.54 143.94 51.05 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.666 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 96.5 m -121.98 149.56 43.29 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 177.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -110.91 131.99 54.58 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.997 0.427 . . . . 0.0 110.535 177.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 -104.41 114.91 29.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.811 176.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.1 m -67.84 -32.69 73.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.987 -177.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.0 t -60.27 -39.48 86.96 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.719 0.295 . . . . 0.0 110.9 -177.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -94.45 -21.42 18.92 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 26.5 t30 69.41 43.78 1.0 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.348 0.594 . . . . 0.0 109.739 -177.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.5 mt-10 -150.43 161.83 41.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.124 -177.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.439 ' CB ' HD12 ' B' 1338 ' ' LEU . 81.8 m95 -94.89 140.0 30.54 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.416 177.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -119.75 126.42 51.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.477 . . . . 0.0 109.951 176.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.9 ttpm? -74.4 140.12 44.51 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 178.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 74.3 p -92.25 176.46 6.48 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.412 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -88.36 13.39 11.81 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 45.2 t -108.1 106.42 20.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 121.03 0.443 . . . . 0.0 110.475 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -129.35 112.75 14.16 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 174.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.56 38.96 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 120.114 -1.041 . . . . 0.0 112.237 -168.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.47 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.38 136.42 37.67 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 175.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -100.91 126.28 47.53 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.178 -175.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.47 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 6.0 m-85 -129.58 142.25 50.79 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.744 0.307 . . . . 0.0 110.55 177.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.658 HD11 HG23 ' A' ' 116' ' ' ILE . 68.9 mt -101.61 126.87 55.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 171.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.683 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 14.3 m-30 -108.58 137.48 46.46 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.827 0.346 . . . . 0.0 111.229 -177.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 50.9 t60 -112.07 143.25 43.39 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.004 174.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 33.8 tpt85 -142.21 147.89 37.29 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.268 177.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -86.94 28.21 0.93 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.218 -0.447 . . . . 0.0 112.077 -179.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.02 169.79 23.77 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -64.01 125.25 87.58 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.982 -178.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -78.34 140.97 63.2 Favored 'Cis proline' 0 N--CA 1.496 1.642 0 CA-C-N 121.911 1.718 . . . . 0.0 111.843 -1.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -61.54 -42.22 98.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.903 -177.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.459 ' HB3' HD12 ' A' ' 80' ' ' ILE . 77.5 m80 -143.63 139.8 29.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.353 0.596 . . . . 0.0 110.891 -177.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.3 t -149.9 151.26 33.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.303 -177.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.442 HG13 HD11 ' A' ' 80' ' ' ILE . 48.1 mt -113.47 137.67 45.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 -178.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -131.82 142.2 49.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.355 -176.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.4 mt -120.66 130.35 74.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 121.202 0.525 . . . . 0.0 109.662 172.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -96.96 99.56 11.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 114.937 -1.029 . . . . 0.0 109.205 179.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -71.89 107.58 4.72 Favored 'General case' 0 C--N 1.332 -0.181 0 O-C-N 123.666 0.604 . . . . 0.0 111.089 -174.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 78.3 ttt-85 -73.33 -42.41 62.33 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.397 -171.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 48.7 mt -72.27 -45.09 61.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.633 -175.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -95.08 -3.22 48.55 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 -175.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 69.7 p 50.93 42.64 28.44 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.511 0.672 . . . . 0.0 111.183 177.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 32.4 m -127.67 135.53 50.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.334 -179.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.3 p -85.36 136.81 33.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.354 -178.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -132.71 122.17 24.2 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.347 175.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 13.2 p -125.59 150.31 30.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.209 -178.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -148.28 136.37 11.2 Favored Pre-proline 0 CA--C 1.537 0.466 0 CA-C-O 119.106 -0.473 . . . . 0.0 110.567 174.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -75.43 151.01 37.13 Favored 'Trans proline' 0 N--CA 1.498 1.774 0 C-N-CA 121.704 1.602 . . . . 0.0 112.403 179.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.459 HD12 ' HB3' ' A' ' 63' ' ' HIS . 64.5 mt -90.78 125.44 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.151 177.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.414 ' H ' HD11 ' A' ' 84' ' ' LEU . 40.6 p -98.49 160.29 14.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.264 176.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -82.35 -22.09 59.36 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 121.218 -0.515 . . . . 0.0 113.124 -176.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.9 p -87.02 10.15 17.39 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -177.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.414 HD11 ' H ' ' A' ' 81' ' ' THR . 76.7 mt -66.88 131.82 46.7 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 118.109 0.413 . . . . 0.0 111.098 -177.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.9 tt0 -112.35 135.8 52.6 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.901 176.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 70.5 mt -119.23 157.83 27.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.023 0.439 . . . . 0.0 111.087 -175.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -144.08 135.71 25.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.473 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.0 t -97.72 109.33 22.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.994 0.426 . . . . 0.0 111.241 -177.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 12.6 mt-30 -106.57 129.22 24.79 Favored Pre-proline 0 CA--C 1.534 0.362 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 173.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -79.26 128.95 8.42 Favored 'Trans proline' 0 N--CA 1.494 1.551 0 CA-C-N 120.651 1.268 . . . . 0.0 111.878 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -98.71 19.25 26.22 Favored 'Cis proline' 0 N--CA 1.5 1.889 0 CA-C-N 122.121 1.793 . . . . 0.0 113.026 -6.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -112.58 132.94 54.88 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.713 0.292 . . . . 0.0 111.371 -171.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 35.5 tp -90.22 135.04 33.91 Favored 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.702 -172.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.427 HD11 ' CG2' ' A' ' 102' ' ' ILE . 7.5 tp -123.53 143.01 50.46 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.519 -175.419 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 33.8 p90 -143.38 152.27 41.4 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.835 0.35 . . . . 0.0 110.199 175.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 27.0 mtm180 -104.64 144.58 31.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.714 -176.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -129.1 167.76 17.09 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.915 0.864 . . . . 0.0 111.619 -177.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 52.1 tt0 -48.52 149.33 1.68 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.983 -176.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 62.05 30.96 18.03 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.212 -0.904 . . . . 0.0 112.172 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 7.5 m 65.11 35.29 8.04 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.842 0.354 . . . . 0.0 111.541 166.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 90.0 mtt-85 -97.48 147.02 24.66 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.65 HD13 ' CH2' ' B' 1345 ' ' TRP . 73.0 mt -115.57 124.19 71.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 -177.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 81.1 mtm180 -137.24 150.32 47.76 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -146.6 169.44 27.8 Favored Glycine 0 CA--C 1.523 0.555 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.956 -175.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -125.15 136.53 53.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.165 -0.517 . . . . 0.0 110.534 -178.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 70.4 t90 -106.57 125.82 51.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.597 176.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -113.47 146.36 39.71 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.837 0.351 . . . . 0.0 110.646 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -52.32 -36.13 52.51 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.569 177.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 33.1 t-20 -133.21 133.75 43.15 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.786 0.327 . . . . 0.0 110.491 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 22.9 m -61.21 -40.64 94.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.169 -178.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -61.0 -43.18 99.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.322 0.582 . . . . 0.0 110.189 179.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -57.0 -45.19 83.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.569 0.699 . . . . 0.0 110.032 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 46.8 t -59.58 -38.56 81.52 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.766 177.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -58.63 -45.52 89.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.888 0.375 . . . . 0.0 110.484 -177.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 64.1 mtp85 -59.74 -48.22 82.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.539 -178.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.658 HG23 HD11 ' A' ' 54' ' ' ILE . 30.5 mm -58.2 -44.97 88.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.093 0.473 . . . . 0.0 110.044 -178.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 54.3 p -59.51 -44.6 93.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.715 -177.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.51 -43.25 94.17 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.655 -0.978 . . . . 0.0 110.655 -178.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.504 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.6 mt -59.07 -49.13 79.06 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.154 0.502 . . . . 0.0 110.552 -178.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 53.2 t -58.54 -43.05 86.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.207 -177.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -58.24 -43.86 88.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.643 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.51 -38.99 96.71 Favored Glycine 0 CA--C 1.526 0.774 0 N-CA-C 111.461 -0.656 . . . . 0.0 111.461 -179.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 36.8 mt -65.3 -43.98 89.37 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.624 0.249 . . . . 0.0 111.341 179.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 40.8 mt -60.5 -44.55 95.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.078 -176.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -73.33 -37.57 66.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.276 -177.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.7 m -65.73 162.42 18.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.649 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 77.7 tttt . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.5 179.953 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.379 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -66.38 143.08 68.54 Favored 'Trans proline' 0 N--CA 1.496 1.642 0 CA-C-N 119.319 1.56 . . . . 0.0 111.913 -175.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -101.45 145.96 28.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.573 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -77.11 154.19 82.54 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.591 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -76.93 -28.3 6.25 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 121.357 1.371 . . . . 0.0 112.619 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 79.6 mt -56.13 -39.79 72.79 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.904 -179.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 25.9 tp -99.39 127.79 45.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.51 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -124.61 131.52 53.47 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.47 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -64.82 -40.48 95.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.81 -179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -100.63 158.21 16.1 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.649 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 89.6 mtt180 -110.57 148.28 32.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.498 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -89.32 158.11 46.67 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.398 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 15.4 Cg_endo -57.43 153.63 40.04 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 121.34 1.36 . . . . 0.0 111.541 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 25.9 m-85 -139.63 158.01 69.01 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.933 -178.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -57.89 129.0 31.15 Favored 'Trans proline' 0 N--CA 1.495 1.602 0 C-N-CA 121.174 1.249 . . . . 0.0 111.686 -179.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 104.96 -5.16 42.26 Favored Glycine 0 CA--C 1.535 1.325 0 CA-C-O 119.507 -0.607 . . . . 0.0 113.373 179.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -85.88 139.2 31.46 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 118.323 1.061 . . . . 0.0 110.344 175.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 10.4 ttt -61.2 118.13 33.32 Favored Pre-proline 0 CA--C 1.535 0.402 0 CA-C-O 118.669 -0.682 . . . . 0.0 110.255 -178.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -57.43 144.33 92.0 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 121.075 1.183 . . . . 0.0 111.648 175.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 40.1 t30 -97.21 103.31 15.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.602 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1338 ' ' LEU . . . . . 0.439 HD12 ' CB ' ' A' ' 43' ' ' TRP . 17.0 mt -63.75 152.17 87.14 Favored Pre-proline 0 C--N 1.33 -0.279 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.07 139.79 15.36 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 C-N-CA 121.091 1.194 . . . . 0.0 111.158 174.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -97.14 125.88 44.2 Favored Pre-proline 0 CA--C 1.535 0.394 0 CA-C-O 118.442 -0.79 . . . . 0.0 109.706 179.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -78.1 167.12 23.88 Favored 'Trans proline' 0 N--CA 1.496 1.63 0 CA-C-N 120.607 1.253 . . . . 0.0 111.813 177.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -61.54 156.35 47.64 Favored 'Trans proline' 0 N--CA 1.494 1.551 0 C-N-CA 121.292 1.328 . . . . 0.0 111.218 177.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 23.8 tp -49.95 -30.15 9.82 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -176.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -56.53 -36.72 69.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.762 0.315 . . . . 0.0 111.388 -176.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1345 ' ' TRP . . . . . 0.65 ' CH2' HD13 ' A' ' 102' ' ' ILE . 5.9 t90 -61.54 -48.19 82.13 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.851 0.358 . . . . 0.0 110.309 -176.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -64.88 -48.66 73.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.041 0.448 . . . . 0.0 110.863 -178.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 61.8 tt0 -58.56 -43.36 89.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.883 -176.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -59.74 -48.16 82.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.597 -176.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -58.21 -47.59 83.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.135 0.493 . . . . 0.0 110.617 -177.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -60.75 -43.14 98.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.295 -176.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 71.3 tttt -62.47 -45.66 92.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.134 -177.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -59.67 -49.0 79.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.946 -178.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -80.92 14.91 2.0 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -104.55 137.57 42.2 Favored 'General case' 0 C--N 1.333 -0.126 0 O-C-N 122.185 -0.322 . . . . 0.0 110.453 179.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 28.2 tp . . . . . 0 C--O 1.22 -0.478 0 CA-C-O 118.012 -0.995 . . . . 0.0 110.481 179.755 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.229 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -66.44 142.78 66.96 Favored 'Trans proline' 0 N--CA 1.496 1.656 0 CA-C-N 118.911 1.356 . . . . 0.0 111.838 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -58.55 -41.3 85.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.673 -179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 85.9 mtp -134.78 160.17 39.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.622 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -143.03 153.96 43.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.425 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -79.32 99.94 7.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.556 -179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 3.8 tt -85.12 -48.3 9.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.462 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.3 mtt -115.97 172.21 7.3 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.449 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -130.35 161.84 30.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.42 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -57.43 142.53 43.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.59 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 93.2 mt-10 -62.49 -37.78 87.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.232 -177.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 16.6 t -58.71 -47.28 85.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.078 0.466 . . . . 0.0 110.339 -177.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 45.5 mm -59.54 -41.25 84.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.242 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.8 m -60.05 -45.18 93.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.881 0.372 . . . . 0.0 110.631 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 59.9 ttt85 -59.66 -46.98 87.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.993 0.425 . . . . 0.0 110.459 -178.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 86.1 mtp -58.18 -43.13 87.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.232 0.539 . . . . 0.0 110.375 -178.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -60.53 -48.3 82.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.33 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.675 ' HA ' HD12 ' A' ' 14' ' ' ILE . 8.4 tp -60.5 -33.63 72.9 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.058 -178.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.47 -50.04 73.02 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.655 0.264 . . . . 0.0 110.608 179.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.16 -41.36 88.19 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.005 0.431 . . . . 0.0 110.553 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.688 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 95.6 mt -54.18 -52.97 32.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.53 178.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -53.28 -25.33 14.27 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -177.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 55.6 mttm -59.72 -32.65 70.73 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -177.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.2 mm -108.86 -42.78 5.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.958 0.409 . . . . 0.0 110.253 -177.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -117.18 77.32 9.37 Favored Pre-proline 0 CA--C 1.535 0.397 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.912 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -55.35 -20.6 26.22 Favored 'Trans proline' 0 N--CA 1.498 1.774 0 C-N-CA 121.481 1.454 . . . . 0.0 113.431 -175.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.4 p90 -90.6 10.23 26.42 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -174.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.74 126.45 32.4 Favored 'General case' 0 C--O 1.231 0.097 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 175.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -97.9 -40.47 8.48 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.799 -0.361 . . . . 0.0 110.778 -176.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -153.05 156.73 39.3 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.549 -0.461 . . . . 0.0 111.565 -179.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 61.8 mt -93.16 138.1 20.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.068 177.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.2 t -90.05 -45.97 15.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.684 176.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.507 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.9 t0 -156.74 157.62 35.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.85 178.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.6 p -142.49 132.32 24.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.138 0.494 . . . . 0.0 111.205 -179.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 24.7 t -106.16 124.46 49.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.5 176.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.3 m -54.12 -38.22 65.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.302 -171.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 52.7 t-80 -150.39 126.46 10.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.19 0.519 . . . . 0.0 111.651 -178.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.454 HG21 ' HB3' ' A' ' 52' ' ' PHE . 93.4 t -145.14 138.18 21.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.403 -177.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -126.26 149.84 48.82 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.029 -178.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.407 ' HD1' HG21 ' A' ' 46' ' ' THR . 18.9 t80 -98.76 129.99 45.21 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 121.319 0.58 . . . . 0.0 111.682 -176.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -125.43 142.86 51.27 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.461 178.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 90.1 m -121.66 146.61 46.83 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -108.37 131.96 54.22 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.929 0.395 . . . . 0.0 110.395 176.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 31.3 t-20 -104.3 116.13 31.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.91 177.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 86.1 p -68.63 -31.89 71.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.966 -177.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.7 m -61.31 -39.36 90.23 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.777 0.322 . . . . 0.0 110.909 -177.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -93.7 -21.4 19.37 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 28.1 t30 68.96 42.95 1.22 Allowed 'General case' 0 C--O 1.232 0.134 0 CA-C-O 121.299 0.571 . . . . 0.0 109.8 -177.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -151.54 163.99 37.82 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.106 -177.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.441 ' CB ' HD12 ' B' 1338 ' ' LEU . 83.0 m95 -94.92 140.92 29.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.322 177.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -122.89 131.34 53.7 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 176.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.7 pttm -76.15 139.79 41.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.278 178.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.407 HG21 ' HD1' ' A' ' 33' ' ' PHE . 66.3 p -92.32 171.99 8.7 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.699 -0.401 . . . . 0.0 109.944 178.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -85.81 13.82 6.79 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 178.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.6 t -105.15 106.47 20.57 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 CA-C-O 120.959 0.409 . . . . 0.0 110.464 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -130.34 114.94 16.23 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 175.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.58 176.47 38.91 Favored Glycine 0 CA--C 1.52 0.384 0 C-N-CA 120.065 -1.064 . . . . 0.0 112.372 -169.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.465 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -81.64 135.97 35.53 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 175.374 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.454 ' HB3' HG21 ' A' ' 31' ' ' VAL . 7.2 t80 -99.55 128.83 45.67 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.127 -176.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.465 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.2 m-85 -132.08 143.53 50.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.339 177.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.665 HD11 HG23 ' A' ' 116' ' ' ILE . 68.9 mt -101.51 128.41 53.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 171.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.688 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 14.8 m-30 -108.54 135.56 49.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.007 0.432 . . . . 0.0 111.189 -175.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -115.42 142.48 46.65 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.098 176.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -142.07 146.98 36.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.089 178.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -86.87 28.01 0.94 Allowed 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 178.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.36 165.42 34.77 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -63.89 130.34 94.4 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-O 118.563 -0.732 . . . . 0.0 110.206 -177.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -72.84 140.87 69.42 Favored 'Cis proline' 0 N--CA 1.497 1.694 0 CA-C-N 121.717 1.649 . . . . 0.0 111.331 -3.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -66.45 -43.47 85.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.025 -177.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.449 ' CD2' HD22 ' A' ' 123' ' ' LEU . 69.3 m80 -141.78 136.63 30.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.296 0.569 . . . . 0.0 110.768 -176.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.1 t -151.03 152.25 33.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.476 -178.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.466 HG13 HD11 ' A' ' 80' ' ' ILE . 43.9 mt -109.3 140.07 29.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -131.75 141.99 49.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.733 -177.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.4 mt -126.48 130.12 71.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.265 0.555 . . . . 0.0 110.076 173.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -97.81 99.86 11.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 114.946 -1.025 . . . . 0.0 109.776 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -73.27 107.12 5.41 Favored 'General case' 0 C--N 1.331 -0.212 0 O-C-N 123.802 0.689 . . . . 0.0 110.958 -176.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -71.81 -49.2 40.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.456 -171.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 44.0 mt -67.49 -45.01 77.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.519 -175.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -95.08 -3.0 48.95 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -174.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 11.5 t 44.63 41.39 4.83 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.348 0.594 . . . . 0.0 112.015 178.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 40.1 m -121.25 137.5 54.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.074 -0.967 . . . . 0.0 109.87 178.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 77.5 p -81.06 132.99 35.4 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.586 -176.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -119.66 122.16 40.88 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 174.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 38.2 t -125.53 145.81 32.29 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 120.68 0.276 . . . . 0.0 110.672 -177.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -148.15 126.36 5.96 Favored Pre-proline 0 CA--C 1.538 0.514 0 CA-C-O 118.621 -0.704 . . . . 0.0 110.464 173.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -75.45 150.86 36.87 Favored 'Trans proline' 0 N--CA 1.499 1.838 0 C-N-CA 121.571 1.514 . . . . 0.0 112.316 177.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.466 HD11 HG13 ' A' ' 65' ' ' ILE . 67.3 mt -94.25 135.6 28.1 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-O 120.934 0.397 . . . . 0.0 110.077 177.212 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.5 p -132.1 157.7 43.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.795 177.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -89.57 32.93 4.55 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.286 -178.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.6 t -111.07 -20.56 12.35 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 173.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.6 mt -68.69 146.49 52.93 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.878 0.37 . . . . 0.0 111.133 -176.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -121.78 135.91 54.93 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.847 176.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 65.5 mt -113.87 159.0 20.32 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.698 -177.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -148.01 141.51 25.4 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 177.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.9 t -107.12 109.32 21.13 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.92 0.39 . . . . 0.0 111.209 -178.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -106.79 103.63 47.88 Favored Pre-proline 0 CA--C 1.532 0.277 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 170.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -64.03 145.32 89.53 Favored 'Trans proline' 0 N--CA 1.497 1.722 0 CA-C-N 120.523 1.223 . . . . 0.0 111.85 -170.188 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -93.95 18.43 37.95 Favored 'Cis proline' 0 N--CA 1.498 1.779 0 CA-C-N 120.904 1.358 . . . . 0.0 113.183 -3.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -110.59 159.96 17.09 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 110.342 -0.244 . . . . 0.0 110.342 -176.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 31.3 tp -110.76 133.63 53.17 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 122.075 -0.39 . . . . 0.0 111.275 -177.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.459 HD11 ' CG2' ' A' ' 102' ' ' ILE . 9.2 tp -122.08 140.28 52.71 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.141 -174.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 36.2 p90 -143.16 157.83 44.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.776 0.322 . . . . 0.0 110.467 176.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 31.0 mtm105 -101.85 147.33 26.64 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.893 0.378 . . . . 0.0 110.917 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -128.51 160.8 31.19 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.968 0.889 . . . . 0.0 111.619 -177.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -48.75 148.97 1.91 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.06 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 43.5 mtp180 64.25 30.9 13.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.252 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 47.8 t 67.62 35.24 4.16 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.94 0.4 . . . . 0.0 111.586 165.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -101.89 151.26 22.31 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.633 HD13 ' CH2' ' B' 1345 ' ' TRP . 74.2 mt -114.1 126.19 71.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -179.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -138.06 150.37 46.84 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -148.51 169.46 29.09 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.043 -175.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -125.15 138.84 54.15 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.992 0.425 . . . . 0.0 110.663 -178.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 44.7 t90 -107.05 125.71 51.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.693 176.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.407 ' CD2' HG22 ' A' ' 31' ' ' VAL . 60.7 m-85 -111.68 144.4 41.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.827 0.346 . . . . 0.0 110.669 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -52.39 -38.03 57.94 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.553 178.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 -131.48 134.35 46.07 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.761 0.315 . . . . 0.0 110.494 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.8 m -61.87 -42.46 99.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.064 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -59.84 -43.39 94.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.371 0.605 . . . . 0.0 110.061 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -56.68 -44.22 81.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.509 0.671 . . . . 0.0 110.12 178.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 42.6 t -59.92 -40.27 88.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.675 178.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -59.57 -44.53 93.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.777 0.323 . . . . 0.0 110.674 -177.16 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -59.74 -49.5 77.5 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.011 0.434 . . . . 0.0 110.461 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.665 HG23 HD11 ' A' ' 54' ' ' ILE . 30.3 mm -58.3 -45.02 89.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.14 0.495 . . . . 0.0 110.038 -178.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 56.5 p -59.43 -43.51 93.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.733 -177.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.62 -43.9 94.13 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 110.653 -0.979 . . . . 0.0 110.653 -178.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.507 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.2 mt -59.12 -49.89 76.16 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.063 0.458 . . . . 0.0 110.601 -178.341 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 56.9 t -58.93 -42.81 87.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.129 -178.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -57.77 -43.25 85.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.535 -178.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -60.9 -44.97 97.46 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 111.016 -0.833 . . . . 0.0 111.016 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.449 HD22 ' CD2' ' A' ' 63' ' ' HIS . 61.7 mt -57.77 -42.87 84.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.966 0.413 . . . . 0.0 110.488 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 70.4 mt -59.85 -41.89 92.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.686 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 18.1 pttm -97.62 11.21 37.76 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 27.2 t -126.11 139.63 53.22 Favored 'General case' 0 C--O 1.231 0.082 0 O-C-N 122.064 -0.398 . . . . 0.0 110.42 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 67.9 mttm . . . . . 0 C--O 1.221 -0.421 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.606 179.998 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.405 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -64.91 140.91 68.71 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 CA-C-N 119.322 1.561 . . . . 0.0 111.923 -175.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -120.91 148.55 43.9 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.518 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 44.6 m-20 -82.47 156.78 68.33 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.544 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -86.04 27.62 0.58 Allowed 'Trans proline' 0 N--CA 1.492 1.407 0 C-N-CA 121.572 1.514 . . . . 0.0 112.825 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 29.2 tp -62.61 -39.74 94.73 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.739 0.304 . . . . 0.0 110.779 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.2 mt -78.33 147.29 34.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.509 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -72.43 155.82 39.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.554 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 57.5 tp60 -56.26 -39.93 73.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.802 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 97.4 mm-40 -65.69 146.23 55.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.452 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 32.9 ttp180 -77.98 120.41 22.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.591 -179.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1329 ' ' ALA . . . . . 0.457 ' HB1' ' HD2' ' B' 1330 ' ' PRO . . . -108.57 162.45 19.91 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.329 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B 1330 ' ' PRO . . . . . 0.457 ' HD2' ' HB1' ' B' 1329 ' ' ALA . 9.6 Cg_endo -52.95 160.53 4.06 Favored 'Trans proline' 0 N--CA 1.495 1.559 0 C-N-CA 121.354 1.37 . . . . 0.0 111.601 179.339 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -93.18 99.9 3.65 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 119.132 -0.461 . . . . 0.0 110.494 -179.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -58.64 128.98 30.2 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 121.114 1.21 . . . . 0.0 111.6 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 99.59 -5.16 58.4 Favored Glycine 0 CA--C 1.536 1.345 0 CA-C-O 119.566 -0.575 . . . . 0.0 113.4 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -64.55 137.31 57.78 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 118.23 1.015 . . . . 0.0 110.432 178.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 7.8 ttp -92.98 118.13 67.76 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 118.531 -0.747 . . . . 0.0 110.385 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -53.61 141.99 61.89 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 CA-C-N 120.543 1.229 . . . . 0.0 111.744 177.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 40.2 t30 -87.53 107.68 18.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.52 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1338 ' ' LEU . . . . . 0.441 HD12 ' CB ' ' A' ' 43' ' ' TRP . 17.6 mt -68.58 151.3 97.32 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.288 -0.415 . . . . 0.0 109.97 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -79.17 139.86 15.24 Favored 'Trans proline' 0 N--CA 1.492 1.393 0 C-N-CA 121.2 1.267 . . . . 0.0 111.201 174.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -97.03 125.7 45.12 Favored Pre-proline 0 CA--C 1.535 0.377 0 CA-C-O 118.8 -0.619 . . . . 0.0 110.022 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -74.15 155.61 47.1 Favored 'Trans proline' 0 N--CA 1.496 1.636 0 C-N-CA 121.488 1.459 . . . . 0.0 111.774 173.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -53.63 154.68 15.37 Favored 'Trans proline' 0 N--CA 1.496 1.625 0 C-N-CA 121.341 1.361 . . . . 0.0 111.561 177.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1343 ' ' LEU . . . . . 0.541 ' H ' HD12 ' B' 1343 ' ' LEU . 6.2 mp -50.42 -29.63 10.63 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -176.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -55.52 -38.58 69.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.865 0.364 . . . . 0.0 111.138 -177.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1345 ' ' TRP . . . . . 0.633 ' CH2' HD13 ' A' ' 102' ' ' ILE . 8.9 t90 -60.97 -48.08 83.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.136 -177.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -61.29 -49.88 75.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.14 0.495 . . . . 0.0 110.592 -177.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -60.17 -46.21 90.45 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.006 -175.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -58.69 -46.15 87.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.717 -176.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.99 -49.32 77.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.881 -177.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -59.15 -43.77 92.07 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.312 -175.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 61.0 mttp -67.15 -49.55 64.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.534 -177.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 61.3 tt0 -55.08 -49.04 72.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.352 -176.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 65.1 tt0 -68.42 -36.99 79.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.238 -179.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -56.62 141.64 42.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.841 0.353 . . . . 0.0 110.723 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 78.1 mt . . . . . 0 C--O 1.221 -0.426 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.526 -179.982 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.333 0 N-CA-C 109.616 -1.393 . . . . 0.0 109.616 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.98 -33.27 32.95 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 CA-C-N 118.853 1.326 . . . . 0.0 112.072 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -57.11 -41.36 78.82 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.686 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 85.8 mtp -97.44 125.01 41.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.561 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -103.57 132.04 50.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.601 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -93.54 126.88 38.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.5 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 78.5 mt -57.11 -41.6 79.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.618 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.9 mtm -142.55 135.45 28.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.48 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.22 144.75 32.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.608 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -83.58 111.67 19.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.448 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -65.14 -32.99 74.96 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.608 -179.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.6 m -56.33 -40.79 74.99 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.855 0.36 . . . . 0.0 110.737 -177.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.3 mm -60.64 -47.3 93.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.203 -178.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 32.1 m -58.92 -43.67 91.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.531 -177.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -59.62 -45.35 92.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.488 -178.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 66.5 mtt -58.21 -44.35 88.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.117 0.484 . . . . 0.0 110.434 -178.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.9 m120 -60.37 -48.91 79.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.383 -178.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.628 ' HA ' HD12 ' A' ' 14' ' ' ILE . 9.4 tp -60.76 -32.89 72.18 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.21 -178.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.62 -49.92 73.3 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.638 0.256 . . . . 0.0 110.686 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.87 -41.95 88.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.021 0.439 . . . . 0.0 110.514 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.672 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 93.4 mt -54.27 -52.97 33.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.632 178.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 85.5 mttt -53.84 -20.72 6.23 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -58.29 -34.88 71.02 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 122.266 -0.271 . . . . 0.0 111.589 -178.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.728 HG21 ' CB ' ' A' ' 75' ' ' SER . 46.6 mm -112.97 -39.51 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 CA-C-O 120.757 0.313 . . . . 0.0 110.617 -177.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -117.18 77.2 9.29 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.178 -178.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -55.99 -21.09 32.59 Favored 'Trans proline' 0 N--CA 1.497 1.735 0 C-N-CA 121.491 1.461 . . . . 0.0 113.432 -175.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 37.2 p90 -89.11 7.05 37.1 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -174.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -80.61 122.67 27.37 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 174.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.0 ttmm -97.71 -40.4 8.59 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.846 -174.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -149.29 152.53 36.05 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.344 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 41.5 mt -93.27 137.18 23.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.875 177.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.1 t -90.21 -45.99 14.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.704 177.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.496 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -156.49 157.08 34.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.908 178.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.8 p -142.39 132.79 25.0 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.996 0.426 . . . . 0.0 111.12 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 14.9 t -107.83 126.35 52.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.663 175.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 88.1 p -54.81 -37.94 66.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.343 -171.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.5 t-80 -150.31 125.91 10.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.116 0.484 . . . . 0.0 111.724 -178.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.449 HG22 ' CD1' ' A' ' 107' ' ' PHE . 95.6 t -145.24 143.67 21.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.774 -177.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -131.21 149.48 52.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.866 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -99.22 131.29 45.35 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.261 0.553 . . . . 0.0 111.475 -177.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -124.68 139.71 53.6 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.507 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 72.7 m -119.92 146.8 45.45 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 177.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -106.8 132.03 53.23 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 120.983 0.42 . . . . 0.0 110.381 175.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 30.3 t-20 -104.42 115.79 30.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.947 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.0 m -67.54 -33.01 74.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.899 -177.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.3 p -61.63 -38.57 88.17 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 121.023 -0.271 . . . . 0.0 110.916 -177.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -93.75 -21.42 19.33 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 69.03 42.5 1.26 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.268 0.556 . . . . 0.0 109.825 -177.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -152.27 165.1 35.95 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.144 -177.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.456 ' CB ' HD12 ' B' 1338 ' ' LEU . 85.8 m95 -93.88 141.42 28.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.357 177.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -125.03 126.48 45.47 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 176.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -72.86 141.05 47.95 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 177.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 63.3 p -92.19 177.38 6.17 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.254 -178.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -87.09 14.19 8.0 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 45.2 t -109.28 106.37 20.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 120.966 0.412 . . . . 0.0 110.366 179.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -129.91 111.9 13.01 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 173.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.71 176.49 39.01 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 120.192 -1.004 . . . . 0.0 112.176 -168.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.483 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.09 135.43 37.71 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 174.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -100.42 128.26 46.53 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 -176.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.483 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.0 m-85 -131.56 143.04 50.08 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.249 177.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.638 HD11 HG23 ' A' ' 116' ' ' ILE . 69.6 mt -101.54 127.78 54.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 172.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.672 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.8 m-30 -108.48 137.35 46.58 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.984 0.421 . . . . 0.0 111.298 -175.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 30.5 t60 -117.78 143.25 46.41 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.173 175.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 62.6 ttt180 -142.03 148.37 38.36 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.093 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -86.95 28.15 0.94 Allowed 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.95 164.76 36.52 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -64.01 129.47 93.94 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-O 118.491 -0.766 . . . . 0.0 110.012 -177.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.93 140.87 69.71 Favored 'Cis proline' 0 N--CA 1.497 1.71 0 CA-C-N 121.804 1.68 . . . . 0.0 111.693 -1.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -65.61 -44.72 85.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.007 -177.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -142.79 137.37 29.66 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.442 0.639 . . . . 0.0 110.924 -176.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.4 t -150.61 152.3 33.85 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.326 -177.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.432 HG13 HD11 ' A' ' 80' ' ' ILE . 46.1 mt -110.86 138.54 38.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -179.147 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -131.87 141.93 49.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.066 -176.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.1 mt -123.06 133.25 69.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.218 0.532 . . . . 0.0 109.872 172.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -100.77 99.56 10.11 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.553 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.2 t-20 -71.53 108.58 4.99 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 123.716 0.635 . . . . 0.0 111.023 -175.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -74.82 -38.37 62.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.405 -171.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 67.0 mt -72.9 -45.17 59.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.46 -175.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 49.5 m-20 -95.12 -3.08 48.67 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -175.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.9 p 51.34 42.39 29.07 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 121.507 0.67 . . . . 0.0 111.03 178.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 40.9 m -127.44 149.07 50.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.812 179.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.728 ' CB ' HG21 ' A' ' 17' ' ' ILE . 52.7 p -101.86 144.77 30.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.896 0.379 . . . . 0.0 111.292 -177.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -138.6 122.25 17.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.189 177.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.7 p -125.55 148.93 30.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.074 -178.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 48.3 tt0 -147.9 136.61 11.5 Favored Pre-proline 0 CA--C 1.537 0.48 0 CA-C-O 119.059 -0.496 . . . . 0.0 110.597 175.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -75.31 150.89 37.5 Favored 'Trans proline' 0 N--CA 1.497 1.733 0 C-N-CA 121.673 1.582 . . . . 0.0 112.435 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.432 HD11 HG13 ' A' ' 65' ' ' ILE . 65.2 mt -90.59 123.69 42.87 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-O 120.935 0.398 . . . . 0.0 110.382 178.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.0 p -99.15 160.88 13.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.003 176.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -98.23 6.03 61.37 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 120.972 -0.632 . . . . 0.0 113.683 -177.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 62.7 m -100.34 -0.96 37.33 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.035 0.917 . . . . 0.0 113.034 177.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.1 mt -69.23 139.92 54.5 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-N 118.105 0.412 . . . . 0.0 111.411 -177.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.7 tt0 -111.43 135.82 51.45 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.991 -0.549 . . . . 0.0 109.539 174.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 74.4 mt -112.99 156.91 22.22 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.149 0.499 . . . . 0.0 111.371 -175.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -142.09 140.0 32.4 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 27.7 t -104.83 109.1 20.92 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.982 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -106.94 103.69 48.59 Favored Pre-proline 0 C--N 1.329 -0.297 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 170.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.1 141.49 48.06 Favored 'Trans proline' 0 N--CA 1.497 1.685 0 CA-C-N 120.627 1.26 . . . . 0.0 111.833 -172.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -90.54 11.74 57.89 Favored 'Cis proline' 0 N--CA 1.498 1.773 0 CA-C-N 121.154 1.448 . . . . 0.0 113.699 -3.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -91.3 170.7 9.77 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.544 0.211 . . . . 0.0 110.806 -177.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 47.4 tp -120.8 135.96 55.02 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 173.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.473 HD11 ' CG2' ' A' ' 102' ' ' ILE . 9.3 tp -127.14 140.02 52.55 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -175.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -143.77 155.91 44.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.878 0.371 . . . . 0.0 110.602 175.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 27.5 mtm105 -101.9 146.62 27.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.723 -178.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -128.07 163.75 23.91 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.722 0.772 . . . . 0.0 111.385 -177.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -47.31 146.17 2.06 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.227 -177.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 25.1 mmt85 65.12 30.9 11.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.173 -0.922 . . . . 0.0 112.136 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.6 m 66.36 35.17 5.9 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.898 0.38 . . . . 0.0 111.616 166.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -99.35 150.06 22.52 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.473 ' CG2' HD11 ' A' ' 94' ' ' LEU . 77.8 mt -114.47 127.76 71.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 121.076 0.465 . . . . 0.0 109.774 -178.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 90.3 mtt180 -137.24 145.91 44.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.412 178.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.85 169.35 25.29 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -125.29 138.77 54.09 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.783 0.325 . . . . 0.0 110.909 -178.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 77.8 t90 -104.09 126.74 51.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.517 175.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.449 ' CD1' HG22 ' A' ' 31' ' ' VAL . 68.6 m-85 -115.6 141.37 48.16 Favored 'General case' 0 C--N 1.33 -0.276 0 O-C-N 123.244 0.34 . . . . 0.0 110.563 -179.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -50.68 -37.96 44.08 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.785 178.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -133.52 137.29 45.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.305 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.2 t -62.21 -42.36 99.22 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.127 -178.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -59.32 -44.29 92.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.425 0.631 . . . . 0.0 110.043 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -56.78 -44.05 81.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.088 178.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 51.8 t -58.93 -39.01 80.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.551 177.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -59.09 -46.19 88.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.8 0.333 . . . . 0.0 110.566 -177.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.9 mtm105 -61.4 -49.92 74.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.745 -177.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.638 HG23 HD11 ' A' ' 54' ' ' ILE . 28.1 mm -58.54 -43.88 88.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.033 0.444 . . . . 0.0 109.955 -178.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 57.3 p -59.81 -44.25 94.1 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.674 -177.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.54 -43.91 93.99 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 -178.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.496 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.5 mt -58.8 -48.67 80.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.142 0.496 . . . . 0.0 110.508 -178.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 54.7 t -59.0 -42.85 87.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.146 -178.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -57.36 -42.66 82.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.915 0.388 . . . . 0.0 110.566 -178.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.68 -43.54 99.12 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.243 -0.743 . . . . 0.0 111.243 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.7 mt -60.76 -42.2 96.97 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.801 0.334 . . . . 0.0 110.832 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 81.0 mt -62.38 -44.15 97.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.139 -177.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 24.8 pttt -78.46 -21.25 49.35 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -177.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 67.2 m -104.99 148.37 26.79 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.758 0.313 . . . . 0.0 110.521 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 80.5 tttt . . . . . 0 C--O 1.219 -0.521 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.541 179.822 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.353 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.77 142.6 25.01 Favored 'Trans proline' 0 N--CA 1.496 1.646 0 CA-C-N 118.859 1.329 . . . . 0.0 112.037 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -104.36 149.8 25.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.489 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -64.81 153.13 88.84 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.512 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -85.43 86.76 1.02 Allowed 'Trans proline' 0 N--CA 1.49 1.317 0 C-N-CA 121.553 1.502 . . . . 0.0 112.288 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 29.8 tp -58.16 -41.57 84.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.52 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.5 mt -102.86 139.75 38.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.477 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -137.43 166.34 24.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.599 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -56.82 -40.21 75.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.749 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -87.99 178.41 6.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.656 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 95.2 mtt-85 -57.69 141.4 48.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.568 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -77.9 158.53 77.69 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.476 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -66.23 133.22 32.13 Favored 'Trans proline' 0 N--CA 1.496 1.655 0 C-N-CA 121.275 1.317 . . . . 0.0 111.875 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -149.98 159.69 35.1 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.538 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -57.9 129.0 31.17 Favored 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 121.124 1.216 . . . . 0.0 111.741 -178.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 99.27 -5.05 58.84 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-O 119.484 -0.62 . . . . 0.0 113.443 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -92.1 151.6 20.34 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 118.271 1.036 . . . . 0.0 110.596 178.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 3.5 ttp -65.52 120.56 69.19 Favored Pre-proline 0 CA--C 1.536 0.41 0 CA-C-O 118.487 -0.768 . . . . 0.0 110.279 -179.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -50.34 147.86 15.63 Favored 'Trans proline' 0 N--CA 1.498 1.777 0 CA-C-N 120.488 1.21 . . . . 0.0 111.827 178.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 21.3 m120 -100.51 123.04 44.19 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.586 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1338 ' ' LEU . . . . . 0.456 HD12 ' CB ' ' A' ' 43' ' ' TRP . 14.6 mt -90.6 148.92 39.75 Favored Pre-proline 0 C--N 1.33 -0.273 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -79.14 139.7 15.18 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 C-N-CA 121.177 1.252 . . . . 0.0 111.366 174.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -97.17 125.94 43.95 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-O 118.463 -0.78 . . . . 0.0 109.628 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo -78.1 161.58 29.4 Favored 'Trans proline' 0 N--CA 1.496 1.656 0 C-N-CA 121.187 1.258 . . . . 0.0 111.929 178.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -49.91 157.0 2.94 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 C-N-CA 121.345 1.363 . . . . 0.0 111.838 177.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 81.2 mt -49.98 -23.56 2.08 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -177.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -58.33 -36.34 73.27 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.702 0.286 . . . . 0.0 111.497 -176.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1345 ' ' TRP . . . . . 0.444 ' CH2' HD13 ' A' ' 102' ' ' ILE . 49.1 t90 -65.06 -48.4 73.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.685 -0.234 . . . . 0.0 111.061 -173.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -70.84 -40.13 72.56 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.618 -0.433 . . . . 0.0 110.881 -176.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -61.05 -46.27 91.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.858 0.361 . . . . 0.0 110.578 -179.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -59.83 -47.75 84.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.616 -176.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.07 -47.79 83.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.981 0.419 . . . . 0.0 110.773 -177.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -60.56 -44.75 95.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.319 -175.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 54.9 mmtt -65.41 -47.07 77.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.373 -177.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -55.46 -48.94 73.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.195 -177.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 43.4 tp10 -65.03 -36.99 86.14 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.141 179.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -79.27 154.63 29.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.817 0.342 . . . . 0.0 110.561 -179.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 78.3 mt . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 118.022 -0.989 . . . . 0.0 110.587 179.857 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.398 0 N-CA-C 110.607 -0.997 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -66.11 -34.31 37.64 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 CA-C-N 119.319 1.56 . . . . 0.0 111.981 -175.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -96.06 -42.55 8.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.526 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 72.2 mtm -108.97 147.4 32.32 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.493 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -85.05 127.95 34.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.584 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -59.97 -38.72 83.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.935 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 79.2 mt -55.95 -39.53 71.86 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.957 -179.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 72.0 mtm -95.92 140.49 30.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.581 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.92 143.43 28.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.571 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -71.41 136.91 47.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.656 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.8 mp0 -69.5 -34.93 75.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.451 -179.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.5 m -57.01 -41.91 79.36 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.876 0.37 . . . . 0.0 110.571 -177.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.9 mm -60.34 -45.11 96.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.133 -178.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.3 m -59.21 -44.75 92.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.924 0.392 . . . . 0.0 110.561 -177.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -60.12 -45.64 92.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.482 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 66.2 mtt -58.13 -42.43 85.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.992 0.425 . . . . 0.0 110.457 -178.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -60.93 -50.52 73.08 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.251 -178.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.739 ' HA ' HD12 ' A' ' 14' ' ' ILE . 13.1 tp -59.84 -30.34 68.88 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.794 -0.363 . . . . 0.0 111.32 -179.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.3 -51.99 60.72 Favored 'General case' 0 C--N 1.332 -0.153 0 O-C-N 122.161 -0.337 . . . . 0.0 110.754 178.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.65 -40.83 80.17 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.027 0.441 . . . . 0.0 110.553 179.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.739 HD12 ' HA ' ' A' ' 11' ' ' LEU . 93.9 mt -54.12 -53.01 31.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.608 178.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -51.9 -25.19 7.52 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -178.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -59.26 -34.37 72.16 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -177.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.5 mm -106.53 -44.79 7.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.112 0.482 . . . . 0.0 109.938 -177.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -117.2 77.49 9.57 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.628 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -55.05 -20.66 24.3 Favored 'Trans proline' 0 N--CA 1.497 1.704 0 C-N-CA 121.491 1.461 . . . . 0.0 113.631 -174.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.3 p90 -89.03 2.06 54.61 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -174.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -78.59 130.23 35.69 Favored 'General case' 0 C--O 1.231 0.093 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 175.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -108.84 -39.25 5.39 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.025 -174.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.3 tt0 -131.63 146.03 51.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.995 0.426 . . . . 0.0 111.137 -175.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.467 HG13 HD13 ' A' ' 11' ' ' LEU . 58.7 mt -100.54 132.07 46.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.681 172.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.1 t -91.59 -47.12 14.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.098 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.516 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -157.22 157.51 34.47 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.953 178.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 64.2 p -143.64 132.24 22.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.119 0.485 . . . . 0.0 111.234 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.6 t -107.05 126.59 52.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.551 176.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.6 m -54.54 -38.87 67.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.313 -172.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 -149.81 126.6 11.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.119 0.485 . . . . 0.0 111.68 -178.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.424 HG21 ' HB3' ' A' ' 52' ' ' PHE . 93.8 t -145.22 140.53 22.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.09 -0.959 . . . . 0.0 109.531 -177.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.56 149.84 51.15 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.684 0.278 . . . . 0.0 111.203 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.527 ' CD2' HG21 ' A' ' 46' ' ' THR . 14.2 t80 -98.5 131.03 45.07 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 121.365 0.602 . . . . 0.0 111.798 -176.251 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -127.5 140.41 52.16 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.199 177.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.3 m -121.66 145.49 47.95 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -109.15 131.0 55.48 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.913 0.387 . . . . 0.0 110.344 177.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 29.7 t-20 -101.94 115.21 30.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.835 176.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 85.4 p -68.71 -31.35 70.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.998 -0.547 . . . . 0.0 112.015 -177.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.1 m -62.44 -37.81 87.32 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.652 0.263 . . . . 0.0 111.076 -178.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -95.59 -21.45 18.23 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -178.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 54.8 t30 69.4 46.08 0.79 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.524 0.678 . . . . 0.0 109.425 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 74.5 tt0 -155.06 151.46 28.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.058 -177.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.425 ' CB ' HD12 ' B' 1338 ' ' LEU . 85.6 m95 -88.18 141.85 28.23 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.307 176.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -121.93 129.01 52.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.881 176.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -74.53 136.92 42.15 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 178.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.527 HG21 ' CD2' ' A' ' 33' ' ' PHE . 71.5 p -92.3 169.88 10.24 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.188 -178.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.4 p-10 -83.12 11.13 6.78 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.8 t -101.62 106.47 19.7 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-O 120.934 0.397 . . . . 0.0 110.287 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -131.51 111.37 11.71 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 175.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.63 176.57 38.94 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.015 -1.088 . . . . 0.0 112.307 -168.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.485 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -80.6 134.9 35.97 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 174.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.424 ' HB3' HG21 ' A' ' 31' ' ' VAL . 5.4 t80 -99.21 128.37 45.33 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 -176.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.485 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.2 m-85 -132.52 143.05 49.48 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.341 177.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.649 HD11 HG23 ' A' ' 116' ' ' ILE . 68.9 mt -101.59 127.71 54.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 172.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.66 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 15.3 m-30 -108.44 138.29 44.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.845 0.355 . . . . 0.0 111.608 -176.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 64.1 t60 -114.66 143.37 45.14 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.283 174.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 29.3 ttp180 -141.46 152.35 44.15 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.481 177.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -86.95 28.19 0.93 Allowed 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.844 -0.617 . . . . 0.0 112.14 -178.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -155.45 152.15 28.64 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -63.98 133.51 95.61 Favored Pre-proline 0 CA--C 1.541 0.598 0 CA-C-O 118.456 -0.783 . . . . 0.0 110.323 -176.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -68.29 140.85 57.98 Favored 'Cis proline' 0 N--CA 1.498 1.746 0 CA-C-N 121.672 1.633 . . . . 0.0 111.409 -0.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -66.61 -38.78 87.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.253 -176.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -141.44 141.11 33.72 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.683 0.754 . . . . 0.0 111.122 -176.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.6 t -149.8 151.31 33.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.912 -178.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 50.4 mt -109.82 140.46 28.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.456 ' HD1' HG22 ' A' ' 77' ' ' VAL . 64.9 t80 -131.79 142.11 49.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.578 -177.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 58.9 mt -123.49 128.62 74.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.186 0.517 . . . . 0.0 109.894 172.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -94.07 99.54 11.82 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.171 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -75.45 106.85 7.2 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.65 0.594 . . . . 0.0 111.045 -174.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.413 HH21 ' HB2' ' A' ' 51' ' ' ALA . 98.6 mtt180 -72.45 -43.49 63.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.565 -171.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 67.3 mt -70.8 -45.17 65.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.731 -174.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 37.2 m-20 -95.09 -3.29 48.38 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -175.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.3 p 50.35 42.29 25.76 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.511 0.672 . . . . 0.0 111.257 177.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.5 m -127.16 145.93 50.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.232 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 97.5 p -88.24 132.64 34.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.248 -178.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -123.07 122.26 38.05 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 174.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.456 HG22 ' HD1' ' A' ' 66' ' ' PHE . 26.3 t -125.42 148.0 30.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 120.764 0.316 . . . . 0.0 110.946 -175.042 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -148.73 126.48 5.73 Favored Pre-proline 0 CA--C 1.539 0.552 0 CA-C-O 118.678 -0.677 . . . . 0.0 110.495 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -75.49 151.0 36.87 Favored 'Trans proline' 0 N--CA 1.499 1.836 0 C-N-CA 121.408 1.405 . . . . 0.0 112.05 177.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 70.3 mt -91.44 112.29 25.18 Favored 'Isoleucine or valine' 0 C--O 1.231 0.125 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.472 179.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 66.0 p -98.94 153.34 18.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.842 175.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -96.59 32.5 6.47 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.355 -178.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.0 m -111.05 -19.13 12.86 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 173.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.9 mt -68.81 145.69 53.53 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.914 0.388 . . . . 0.0 111.452 -175.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 54.8 tt0 -111.76 136.12 51.46 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.819 175.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.439 HD12 ' ND2' ' A' ' 121' ' ' ASN . 64.2 mt -110.97 158.64 18.55 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.709 -177.219 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -149.52 142.95 25.3 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.1 t -100.38 109.18 21.34 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.476 179.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 23.7 mm-40 -106.61 103.67 47.52 Favored Pre-proline 0 C--N 1.329 -0.296 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 173.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -67.5 141.15 54.64 Favored 'Trans proline' 0 N--CA 1.497 1.724 0 CA-C-N 120.512 1.219 . . . . 0.0 111.919 -171.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -90.6 11.14 59.37 Favored 'Cis proline' 0 N--CA 1.499 1.818 0 CA-C-N 121.173 1.455 . . . . 0.0 113.667 -5.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -92.3 170.33 9.88 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.516 0.326 . . . . 0.0 110.67 -176.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 56.2 tp -115.59 134.48 55.02 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 173.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 12.0 tp -127.58 140.23 52.25 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 -173.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -148.17 155.52 41.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.849 0.357 . . . . 0.0 110.477 175.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.2 mtm105 -104.71 147.97 27.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.947 -176.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -128.67 167.34 17.36 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.944 0.878 . . . . 0.0 111.339 -178.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -47.77 148.48 1.55 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.195 -0.912 . . . . 0.0 112.188 -177.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 62.82 30.96 16.65 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.134 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.2 p 65.34 35.33 7.61 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.758 0.313 . . . . 0.0 111.638 166.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 68.5 mtp180 -98.0 147.21 24.73 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 76.9 mt -111.65 127.05 69.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 -177.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -134.26 147.96 50.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.451 -179.117 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.39 166.43 26.81 Favored Glycine 0 CA--C 1.524 0.652 0 C-N-CA 120.901 -0.666 . . . . 0.0 111.621 -178.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -125.27 140.78 52.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.24 -0.48 . . . . 0.0 110.213 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 83.9 t90 -107.42 128.98 54.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.652 175.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -115.46 144.24 44.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.806 0.336 . . . . 0.0 110.76 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -52.1 -35.92 49.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.568 177.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -135.44 135.69 40.75 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.814 0.34 . . . . 0.0 110.487 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.7 t -62.58 -42.32 99.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.188 -177.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.2 mm-40 -59.44 -43.88 93.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.412 0.625 . . . . 0.0 110.099 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -56.42 -45.55 80.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.077 179.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 41.3 t -60.47 -38.59 84.71 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.858 178.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -59.14 -45.57 90.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.829 0.347 . . . . 0.0 110.488 -177.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 -60.58 -48.52 81.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.574 -178.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.649 HG23 HD11 ' A' ' 54' ' ' ILE . 28.5 mm -58.24 -44.94 89.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.044 0.45 . . . . 0.0 109.982 -178.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 57.8 p -59.35 -44.01 92.73 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.692 -177.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.62 -43.96 94.11 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.516 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.7 mt -58.74 -48.6 80.62 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.136 0.493 . . . . 0.0 110.502 -178.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 48.9 t -58.73 -44.12 89.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.141 -178.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.439 ' ND2' HD12 ' A' ' 86' ' ' LEU . 31.3 m120 -58.51 -41.9 86.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.828 -178.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.58 -42.94 99.64 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 111.411 -0.676 . . . . 0.0 111.411 -178.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 47.5 mt -63.29 -43.0 99.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.801 0.334 . . . . 0.0 111.172 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 25.4 mt -64.65 -44.91 88.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.591 -176.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 12.4 pttp -71.88 -37.56 70.15 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.522 -176.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 29.3 t -139.92 153.46 46.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.933 0.397 . . . . 0.0 110.779 -178.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 36.8 tttp . . . . . 0 C--O 1.221 -0.446 0 CA-C-O 117.926 -1.035 . . . . 0.0 110.738 -179.805 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.339 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -68.96 144.03 56.85 Favored 'Trans proline' 0 N--CA 1.496 1.655 0 C-N-CA 121.318 1.346 . . . . 0.0 111.878 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -97.78 118.34 34.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.569 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -83.16 154.75 67.06 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.548 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -86.94 30.63 0.47 Allowed 'Trans proline' 0 N--CA 1.491 1.357 0 C-N-CA 121.704 1.602 . . . . 0.0 112.499 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 78.1 mt -60.59 -39.06 86.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.883 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 27.2 tp -87.94 133.19 33.99 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.6 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -75.96 140.65 42.17 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.617 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -60.27 -39.77 88.02 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.875 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -94.8 120.79 35.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.668 -179.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 41.6 ttt85 -113.12 135.22 54.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.301 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -100.16 155.81 35.99 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.707 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -73.09 142.72 34.8 Favored 'Trans proline' 0 N--CA 1.494 1.558 0 C-N-CA 121.304 1.336 . . . . 0.0 111.897 179.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 33.0 p90 -146.36 153.5 48.18 Favored Pre-proline 0 C--O 1.234 0.255 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.023 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.97 130.02 36.17 Favored 'Trans proline' 0 N--CA 1.495 1.56 0 C-N-CA 121.13 1.22 . . . . 0.0 111.543 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 105.0 -5.13 42.06 Favored Glycine 0 CA--C 1.533 1.209 0 CA-C-O 119.47 -0.628 . . . . 0.0 113.426 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -60.97 156.01 18.66 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 118.417 1.108 . . . . 0.0 110.246 174.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 5.5 ttt -61.16 118.15 33.31 Favored Pre-proline 0 CA--C 1.536 0.417 0 CA-C-O 118.497 -0.763 . . . . 0.0 110.38 -178.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -68.13 158.39 57.67 Favored 'Trans proline' 0 N--CA 1.497 1.702 0 C-N-CA 121.191 1.261 . . . . 0.0 111.755 177.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 42.4 t30 -91.57 110.51 21.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.622 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1338 ' ' LEU . . . . . 0.425 HD12 ' CB ' ' A' ' 43' ' ' TRP . 26.6 mt -74.7 133.8 76.26 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 118.425 -0.797 . . . . 0.0 109.736 179.242 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -79.14 139.61 15.12 Favored 'Trans proline' 0 N--CA 1.494 1.532 0 CA-C-N 120.401 1.179 . . . . 0.0 111.16 174.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 26.3 mtmt -97.26 125.97 43.63 Favored Pre-proline 0 CA--C 1.535 0.384 0 CA-C-O 118.462 -0.78 . . . . 0.0 110.35 178.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -63.64 162.33 28.48 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 CA-C-N 120.697 1.284 . . . . 0.0 111.515 176.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -49.82 156.68 3.09 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 121.316 1.344 . . . . 0.0 111.739 178.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 82.0 mt -50.04 -28.81 7.6 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -176.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 64.0 t80 -55.69 -37.56 68.51 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.814 0.34 . . . . 0.0 111.205 -177.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 52.9 t90 -60.96 -48.13 83.26 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.425 -176.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -63.64 -48.89 75.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.035 0.445 . . . . 0.0 110.618 -178.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.29 -42.42 91.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.017 -176.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -59.37 -49.39 77.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.88 0.371 . . . . 0.0 110.592 -176.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.21 -49.44 77.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.771 -177.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -59.44 -40.97 88.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.331 -175.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 83.2 tttt -66.47 -48.11 70.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.364 -177.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -55.0 -49.07 72.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.233 -177.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -68.19 -35.4 77.94 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.42 179.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -63.96 143.48 57.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.825 0.345 . . . . 0.0 110.639 -178.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1355 ' ' LEU . . . . . 0.475 ' C ' HD23 ' B' 1355 ' ' LEU . 6.6 tt . . . . . 0 C--O 1.221 -0.444 0 CA-C-O 117.96 -1.019 . . . . 0.0 110.496 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.316 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -51.48 -30.81 36.64 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 121.295 1.33 . . . . 0.0 112.309 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -56.26 -42.67 77.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.79 -179.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 85.2 mtp -111.32 144.73 40.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.501 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -146.75 152.58 39.04 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.57 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -85.13 112.61 20.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.573 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 78.9 mt -60.65 -41.5 95.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.623 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.5 mtm -141.13 136.35 31.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.602 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -115.53 151.94 33.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.462 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -132.09 107.41 8.62 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.47 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -61.52 -31.65 71.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.68 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.8 m -55.88 -40.48 73.05 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.932 0.396 . . . . 0.0 110.809 -177.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.3 mm -60.67 -47.72 91.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.13 -178.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.7 m -58.45 -43.43 88.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.466 -177.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 36.6 ttm180 -60.02 -45.76 91.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.644 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 89.7 mtp -58.21 -43.06 87.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.04 0.448 . . . . 0.0 110.448 -178.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -60.69 -50.16 74.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.298 -178.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.729 ' HA ' HD12 ' A' ' 14' ' ' ILE . 14.1 tp -60.66 -30.77 70.1 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.276 -179.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.15 -50.7 69.38 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 122.276 -0.265 . . . . 0.0 110.601 178.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.97 -41.67 83.43 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.001 0.429 . . . . 0.0 110.424 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.729 HD12 ' HA ' ' A' ' 11' ' ' LEU . 94.4 mt -54.23 -52.94 33.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.594 178.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -53.95 -24.38 16.3 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -59.25 -33.22 70.76 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.0 mm -107.9 -42.09 5.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 120.765 0.317 . . . . 0.0 110.298 -177.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 35.9 t0 -115.11 85.47 12.42 Favored Pre-proline 0 CA--C 1.533 0.323 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.709 -175.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -53.75 -24.4 30.28 Favored 'Trans proline' 0 N--CA 1.497 1.709 0 C-N-CA 121.421 1.414 . . . . 0.0 113.319 -177.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.6 p90 -95.5 19.56 10.81 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 -175.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -101.94 118.21 36.43 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 172.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.45 ' O ' HD21 ' A' ' 11' ' ' LEU . 70.3 mmtt -112.98 -33.51 6.03 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 -173.386 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -127.91 142.47 51.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.842 0.354 . . . . 0.0 110.684 -178.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.478 HG13 HD13 ' A' ' 11' ' ' LEU . 57.8 mt -99.43 129.78 49.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.827 173.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.9 t -90.57 -47.23 14.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.268 -0.423 . . . . 0.0 109.943 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.489 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.9 t0 -154.37 154.42 33.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.991 178.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 58.7 p -142.29 131.95 24.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.045 0.45 . . . . 0.0 111.009 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 38.5 t -107.58 126.61 52.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.682 177.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 86.7 p -54.59 -38.05 66.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.232 -172.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 61.0 t-80 -151.15 126.06 9.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.256 0.55 . . . . 0.0 111.523 -179.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.44 HG22 ' CD2' ' A' ' 107' ' ' PHE . 99.6 t -144.86 142.18 23.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.44 -178.018 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -130.53 149.76 52.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.09 -178.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.575 ' CD2' HG21 ' A' ' 46' ' ' THR . 13.7 t80 -97.12 131.02 44.3 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.275 0.559 . . . . 0.0 111.588 -177.401 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.422 ' CD1' HD11 ' B' 1338 ' ' LEU . 34.5 m-85 -124.42 141.18 52.28 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.585 178.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 92.2 m -122.34 145.08 48.59 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 177.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -108.03 130.45 55.07 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 120.893 0.378 . . . . 0.0 110.313 177.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -101.29 114.86 29.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.784 176.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 27.1 m -67.49 -32.94 74.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.842 -177.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.0 m -61.47 -38.41 87.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.635 0.255 . . . . 0.0 111.006 -177.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -94.58 -21.5 18.8 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -178.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 25.8 t30 68.81 45.53 0.99 Allowed 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.426 0.631 . . . . 0.0 109.438 -177.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 78.2 tt0 -154.05 150.95 28.76 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.083 -176.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.416 ' CB ' HD12 ' B' 1338 ' ' LEU . 89.4 m95 -86.51 142.02 28.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.255 176.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -125.04 134.09 52.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.34 -0.391 . . . . 0.0 109.99 176.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -75.53 140.95 43.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.287 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.575 HG21 ' CD2' ' A' ' 33' ' ' PHE . 62.6 p -92.39 172.36 8.44 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.066 178.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -83.86 12.61 5.84 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.9 t -108.41 106.49 20.79 Favored 'Isoleucine or valine' 0 C--O 1.231 0.123 0 CA-C-O 121.067 0.46 . . . . 0.0 110.43 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.6 tt0 -129.96 112.63 13.69 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 173.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.61 176.49 38.93 Favored Glycine 0 CA--C 1.52 0.391 0 C-N-CA 120.192 -1.004 . . . . 0.0 112.354 -168.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.5 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.75 134.79 37.02 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 175.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -100.04 126.9 46.31 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.146 -175.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.5 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 7.3 m-85 -131.52 142.16 49.89 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.767 0.318 . . . . 0.0 110.537 177.059 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.621 HD11 HG23 ' A' ' 116' ' ' ILE . 67.7 mt -101.68 126.72 55.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 172.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.685 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 14.0 m-30 -108.46 137.69 46.01 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.826 0.346 . . . . 0.0 111.343 -176.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 58.1 t60 -114.11 143.29 45.03 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.368 175.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 16.8 tpt180 -142.09 147.53 36.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.427 175.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.8 m120 -86.79 28.17 0.92 Allowed 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.25 171.32 20.41 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -63.98 124.75 86.2 Favored Pre-proline 0 CA--C 1.539 0.535 0 CA-C-O 118.439 -0.791 . . . . 0.0 110.021 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -78.73 140.93 61.65 Favored 'Cis proline' 0 N--CA 1.498 1.746 0 CA-C-N 121.994 1.748 . . . . 0.0 111.906 -0.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -63.83 -46.53 84.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.096 -177.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.465 ' HB3' HD12 ' A' ' 80' ' ' ILE . 77.0 m80 -143.15 138.66 29.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.341 0.591 . . . . 0.0 110.992 -176.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.6 t -150.18 152.06 34.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.37 -178.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.426 HG13 HD11 ' A' ' 80' ' ' ILE . 50.8 mt -114.48 137.14 48.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 -178.148 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -131.91 142.19 49.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.537 -176.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 62.2 mt -120.4 129.93 75.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.2 0.524 . . . . 0.0 109.706 172.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -96.13 99.55 11.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.981 -1.009 . . . . 0.0 109.322 179.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.3 t-20 -71.79 106.28 4.09 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 123.669 0.605 . . . . 0.0 111.062 -174.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -74.01 -40.07 63.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.252 -171.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 72.9 mt -72.05 -45.19 61.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.648 -174.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 60.9 m-20 -95.11 -3.32 48.25 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 -175.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.437 ' O ' HG22 ' A' ' 73' ' ' THR . 13.3 m 55.6 43.18 28.66 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-O 121.493 0.663 . . . . 0.0 110.561 177.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.6 m -127.52 148.9 50.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.56 -177.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.9 p -99.2 135.36 40.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.322 -179.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -131.91 122.23 25.3 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.673 0.273 . . . . 0.0 110.266 175.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.7 p -125.54 149.88 30.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.094 -177.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 26.4 tp10 -147.36 133.95 9.88 Favored Pre-proline 0 CA--C 1.538 0.509 0 CA-C-O 118.861 -0.59 . . . . 0.0 110.302 174.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.42 150.94 37.1 Favored 'Trans proline' 0 N--CA 1.498 1.765 0 C-N-CA 121.54 1.494 . . . . 0.0 112.301 179.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.465 HD12 ' HB3' ' A' ' 63' ' ' HIS . 63.7 mt -89.47 139.5 17.36 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.19 177.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.1 p -132.09 156.88 45.55 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.867 177.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -98.16 37.71 3.37 Favored Glycine 0 CA--C 1.524 0.6 0 C-N-CA 121.0 -0.619 . . . . 0.0 111.832 -178.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 51.6 p -111.07 -23.19 11.06 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 174.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.8 mt -69.09 145.82 53.1 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.977 0.418 . . . . 0.0 111.502 -175.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 57.0 tt0 -113.66 135.92 53.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.556 175.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 68.9 mt -111.12 160.0 17.31 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.99 0.424 . . . . 0.0 110.978 -175.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -149.52 140.76 23.12 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.219 -0.659 . . . . 0.0 109.219 178.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.5 t -99.12 109.19 21.93 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.871 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -106.8 103.81 48.7 Favored Pre-proline 0 C--N 1.329 -0.307 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 172.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -71.67 139.87 34.77 Favored 'Trans proline' 0 N--CA 1.497 1.708 0 CA-C-N 120.501 1.215 . . . . 0.0 112.047 -171.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -88.99 9.49 64.49 Favored 'Cis proline' 0 N--CA 1.501 1.926 0 CA-C-N 121.22 1.471 . . . . 0.0 113.684 -4.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -84.61 170.41 13.4 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.775 0.321 . . . . 0.0 110.986 -177.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.1 tp -118.84 133.34 55.9 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 170.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.421 HD11 ' CG2' ' A' ' 102' ' ' ILE . 10.9 tp -126.01 141.01 52.14 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.538 0.209 . . . . 0.0 110.499 -174.409 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 15.3 p90 -147.4 156.37 42.82 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.799 0.333 . . . . 0.0 110.382 176.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.7 mtm105 -101.93 144.24 30.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.97 0.414 . . . . 0.0 110.734 -178.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -124.95 162.84 23.59 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.738 0.78 . . . . 0.0 111.446 -176.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -47.75 146.21 2.43 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.164 -177.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 65.36 30.92 10.81 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.434 -0.803 . . . . 0.0 112.067 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 43.1 t 66.17 35.19 6.24 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.863 0.363 . . . . 0.0 111.7 164.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.9 mtt-85 -102.93 152.76 20.94 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.469 HD13 ' CH2' ' B' 1345 ' ' TRP . 81.4 mt -111.99 127.75 68.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-O 121.075 0.464 . . . . 0.0 109.813 -176.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 80.4 mtt180 -130.25 147.13 51.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.463 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -142.61 166.29 26.56 Favored Glycine 0 CA--C 1.523 0.537 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 -178.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -126.05 140.84 52.27 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.742 0.306 . . . . 0.0 110.749 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 13.5 t90 -108.5 128.27 54.65 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.608 175.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.44 ' CD2' HG22 ' A' ' 31' ' ' VAL . 58.3 m-85 -117.54 144.22 45.32 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.769 0.319 . . . . 0.0 110.631 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -52.4 -36.79 54.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.582 178.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 39.1 t-20 -134.01 135.05 43.15 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.757 0.313 . . . . 0.0 110.511 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.3 p -61.92 -41.39 97.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.172 -177.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -60.69 -43.18 98.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.421 0.629 . . . . 0.0 110.159 179.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -56.53 -45.31 81.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.579 0.704 . . . . 0.0 109.99 178.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 42.1 t -60.01 -39.27 85.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.705 178.02 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -58.72 -44.91 90.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.907 0.384 . . . . 0.0 110.545 -177.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -60.25 -48.77 80.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.593 -177.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.621 HG23 HD11 ' A' ' 54' ' ' ILE . 31.0 mm -58.51 -45.45 90.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.064 0.459 . . . . 0.0 109.979 -178.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.5 p -59.7 -43.78 93.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.733 -177.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.72 -43.79 94.36 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 110.65 -0.98 . . . . 0.0 110.65 -178.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.489 HD13 ' HB2' ' A' ' 26' ' ' ASP . 10.3 mt -59.15 -48.92 79.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.054 0.454 . . . . 0.0 110.616 -178.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 58.7 t -59.21 -43.13 88.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.056 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 27.3 m120 -57.54 -42.55 83.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.6 -178.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.79 -45.44 96.21 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 -179.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 27.4 mt -58.56 -42.21 87.4 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.876 0.37 . . . . 0.0 110.594 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 80.6 mt -58.74 -41.0 85.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.638 179.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 34.5 pttt -95.93 11.16 34.86 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -179.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 33.3 t -132.03 142.93 49.72 Favored 'General case' 0 C--O 1.231 0.088 0 O-C-N 122.112 -0.367 . . . . 0.0 110.451 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 47.7 pttt . . . . . 0 C--O 1.219 -0.513 0 CA-C-O 118.033 -0.984 . . . . 0.0 110.785 -179.786 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.383 0 N-CA-C 110.636 -0.986 . . . . 0.0 110.636 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -64.8 140.52 67.62 Favored 'Trans proline' 0 N--CA 1.496 1.618 0 CA-C-N 119.346 1.573 . . . . 0.0 111.924 -175.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -109.86 146.94 34.24 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.562 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -83.05 161.02 59.09 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.504 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 23.6 Cg_endo -61.55 -30.58 86.37 Favored 'Trans proline' 0 N--CA 1.498 1.75 0 C-N-CA 121.244 1.296 . . . . 0.0 112.227 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 28.9 tp -56.31 -39.44 72.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.837 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.4 mt -79.79 148.32 31.48 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.481 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -69.32 140.96 54.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.593 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -58.65 -40.57 83.82 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.78 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -69.72 144.88 52.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.604 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 61.5 ttt180 -92.13 132.46 36.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.529 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -84.19 156.27 63.3 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.561 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -66.49 143.14 68.02 Favored 'Trans proline' 0 N--CA 1.496 1.638 0 C-N-CA 121.246 1.297 . . . . 0.0 111.796 179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -129.06 99.89 21.31 Favored Pre-proline 0 CA--C 1.533 0.301 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.526 -179.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -57.89 128.92 30.83 Favored 'Trans proline' 0 N--CA 1.496 1.624 0 C-N-CA 121.05 1.167 . . . . 0.0 111.615 177.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 88.13 7.8 72.96 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 121.202 -0.523 . . . . 0.0 113.299 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -53.2 148.62 8.14 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 118.239 1.019 . . . . 0.0 111.185 178.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 19.7 ttp -61.09 144.89 90.45 Favored Pre-proline 0 CA--C 1.534 0.33 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.204 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 25.9 Cg_exo -60.94 148.83 91.42 Favored 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 121.244 1.296 . . . . 0.0 111.424 175.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -102.3 99.9 10.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.683 -179.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1338 ' ' LEU . . . . . 0.422 HD11 ' CD1' ' A' ' 34' ' ' TYR . 12.0 mt -66.27 150.56 96.87 Favored Pre-proline 0 C--N 1.329 -0.288 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.1 139.74 15.28 Favored 'Trans proline' 0 N--CA 1.493 1.463 0 C-N-CA 121.09 1.193 . . . . 0.0 111.257 175.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 12.1 mmmt -97.13 125.74 44.74 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-O 118.783 -0.627 . . . . 0.0 110.011 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -74.2 155.22 46.91 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 121.396 1.397 . . . . 0.0 111.565 172.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -50.66 157.02 3.83 Favored 'Trans proline' 0 N--CA 1.495 1.569 0 C-N-CA 121.236 1.291 . . . . 0.0 111.721 178.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 82.4 mt -50.04 -26.93 4.84 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -177.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 57.1 t80 -55.15 -38.13 67.87 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.892 0.377 . . . . 0.0 111.086 -177.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1345 ' ' TRP . . . . . 0.469 ' CH2' HD13 ' A' ' 102' ' ' ILE . 46.3 t90 -61.12 -48.04 83.49 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.298 -177.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -60.07 -46.87 88.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.97 0.414 . . . . 0.0 110.421 -177.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -60.41 -43.75 96.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.955 -177.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -59.14 -45.59 90.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.773 -177.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -62.59 -52.91 61.54 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.858 -176.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -61.15 -35.72 77.85 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.482 -176.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 22.8 ttpt -66.05 -49.75 66.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.707 0.289 . . . . 0.0 111.016 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -55.33 -44.49 75.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.04 -178.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 42.8 tp10 -64.86 -37.11 86.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.994 178.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -75.5 143.93 42.27 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.784 0.326 . . . . 0.0 110.542 179.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 25.4 tp . . . . . 0 C--O 1.22 -0.468 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.563 179.997 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -64.27 -30.78 63.98 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 CA-C-N 119.22 1.51 . . . . 0.0 112.231 -175.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -56.0 -39.97 72.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.898 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 65.2 mtt -94.31 149.39 21.29 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.682 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -142.11 157.18 45.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.442 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 18.4 p30 -94.04 154.6 17.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.727 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . 0.515 ' N ' HD12 ' A' ' 0' ' ' LEU . 6.6 mp -67.39 -40.31 85.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.754 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.6 mtp -95.0 136.07 35.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.562 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.59 128.82 44.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.536 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -83.68 147.45 27.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.577 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -60.3 -35.34 75.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.281 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.8 t -57.16 -42.91 81.98 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.043 0.449 . . . . 0.0 110.507 -177.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.4 mm -59.69 -44.53 93.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.18 -178.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.3 m -59.48 -44.97 92.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.449 -177.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -59.55 -45.27 92.31 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.52 -178.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 88.5 mtp -58.22 -43.68 87.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.02 0.438 . . . . 0.0 110.421 -178.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -60.32 -49.22 78.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.269 -178.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.608 ' HA ' HD12 ' A' ' 14' ' ' ILE . 10.7 tp -59.16 -33.85 71.41 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.972 -179.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.37 -50.54 69.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.546 0.212 . . . . 0.0 110.875 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.01 -42.13 84.57 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.976 0.417 . . . . 0.0 110.441 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.608 HD12 ' HA ' ' A' ' 11' ' ' LEU . 94.8 mt -54.22 -52.92 33.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.7 178.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -51.54 -25.13 6.15 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -178.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.5 tptp -57.84 -35.52 71.02 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.603 0.24 . . . . 0.0 111.469 -178.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.3 mm -103.92 -47.88 10.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.119 0.485 . . . . 0.0 109.792 -178.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -117.57 79.18 12.16 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.043 -176.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -54.72 -20.59 22.31 Favored 'Trans proline' 0 N--CA 1.498 1.746 0 C-N-CA 121.545 1.497 . . . . 0.0 113.695 -175.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 19.5 p90 -90.41 5.45 47.45 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -174.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -80.72 125.12 29.65 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 173.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.581 ' O ' HD21 ' A' ' 11' ' ' LEU . 79.7 tttt -104.59 -39.51 6.35 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.814 -0.354 . . . . 0.0 111.124 -172.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -134.41 146.33 49.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.956 0.408 . . . . 0.0 111.27 -175.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.444 HD11 HD12 ' A' ' 14' ' ' ILE . 21.1 mt -100.87 133.65 43.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 172.024 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.7 t -92.39 -47.19 14.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.936 179.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.516 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -152.07 154.18 35.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.068 178.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.4 p -141.82 132.02 24.87 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.01 0.433 . . . . 0.0 110.748 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.7 t -107.4 128.98 54.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.737 176.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 87.3 p -54.58 -37.87 66.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.302 -172.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -152.74 127.34 9.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.231 0.539 . . . . 0.0 111.702 -178.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.402 HG21 ' HB3' ' A' ' 52' ' ' PHE . 97.5 t -145.27 141.82 22.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 114.97 -1.014 . . . . 0.0 109.521 -177.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.92 149.9 51.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.041 -178.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.514 ' HD1' HG21 ' A' ' 46' ' ' THR . 27.1 t80 -100.72 131.64 46.51 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.278 0.561 . . . . 0.0 111.597 -177.005 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -126.5 144.73 50.77 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.826 179.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 84.2 m -122.71 147.94 45.89 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 177.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -108.84 132.0 54.44 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.983 0.421 . . . . 0.0 110.379 176.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.9 t-20 -104.1 114.76 29.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.779 177.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.9 m -67.7 -32.71 73.54 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.969 -176.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.0 t -60.37 -39.71 88.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.757 0.313 . . . . 0.0 110.904 -177.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -94.09 -21.41 19.14 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 69.37 43.97 0.99 Allowed 'General case' 0 C--O 1.232 0.139 0 CA-C-O 121.419 0.628 . . . . 0.0 109.703 -177.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -150.02 163.46 38.08 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.165 -177.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -96.43 139.77 32.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.25 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -123.69 130.28 52.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.083 176.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 50.4 tttm -75.27 142.48 43.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.0 178.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.514 HG21 ' HD1' ' A' ' 33' ' ' PHE . 72.9 p -92.33 177.21 6.21 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.719 -0.393 . . . . 0.0 110.07 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.7 p-10 -86.93 13.6 8.79 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.4 t -109.48 106.39 20.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-O 120.928 0.394 . . . . 0.0 110.619 -179.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -129.95 111.55 12.65 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 173.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.64 176.51 38.95 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 120.261 -0.971 . . . . 0.0 112.256 -168.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.473 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.53 136.72 37.63 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 175.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.402 ' HB3' HG21 ' A' ' 31' ' ' VAL . 4.3 t80 -101.64 126.16 48.43 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.27 -175.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.473 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 5.8 m-85 -129.88 142.25 50.69 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.817 0.341 . . . . 0.0 110.402 177.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.655 HD11 HG23 ' A' ' 116' ' ' ILE . 67.5 mt -101.61 127.02 55.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 172.188 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.593 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.1 m-30 -108.55 139.66 43.01 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.929 0.395 . . . . 0.0 111.516 -176.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -113.13 143.34 44.52 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.014 174.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 30.0 ttp180 -141.13 152.86 45.06 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.59 178.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -86.89 28.11 0.93 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.164 -178.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -155.3 152.35 29.1 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -63.98 133.78 95.71 Favored Pre-proline 0 CA--C 1.541 0.598 0 CA-C-O 118.49 -0.767 . . . . 0.0 110.252 -176.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -68.35 140.91 58.55 Favored 'Cis proline' 0 N--CA 1.499 1.797 0 CA-C-N 121.702 1.644 . . . . 0.0 111.437 -1.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -63.64 -38.72 92.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.189 -177.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -141.06 141.85 34.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.611 0.719 . . . . 0.0 111.086 -176.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.2 t -149.54 152.16 35.08 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.922 -178.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.465 HG13 HD11 ' A' ' 80' ' ' ILE . 54.0 mt -113.03 138.66 41.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 -177.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -131.79 142.09 49.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.146 -177.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.1 mt -121.11 130.55 74.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-O 121.275 0.559 . . . . 0.0 109.815 172.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -96.44 99.58 11.23 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.269 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.7 t-20 -72.16 107.12 4.66 Favored 'General case' 0 C--N 1.332 -0.176 0 O-C-N 123.58 0.55 . . . . 0.0 111.192 -174.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.6 mtm105 -74.51 -39.8 62.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.387 -171.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 56.7 mt -74.2 -45.17 50.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.475 -175.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 39.4 t-20 -95.05 -3.23 48.63 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -175.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 63.3 p 51.52 42.54 29.53 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.479 0.656 . . . . 0.0 110.959 178.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.6 m -124.37 148.92 47.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.201 -179.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 11.2 p -98.97 134.7 41.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.281 -178.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -131.39 122.15 25.83 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.33 175.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.5 p -125.58 149.76 30.49 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.008 -178.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -149.04 132.13 8.18 Favored Pre-proline 0 CA--C 1.538 0.511 0 CA-C-O 118.834 -0.603 . . . . 0.0 110.493 175.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.45 150.92 36.96 Favored 'Trans proline' 0 N--CA 1.499 1.816 0 C-N-CA 121.552 1.501 . . . . 0.0 112.276 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.465 HD11 HG13 ' A' ' 65' ' ' ILE . 66.1 mt -90.81 123.39 42.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.143 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.393 178.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 80.6 p -98.79 163.27 12.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.993 176.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -97.82 15.88 61.13 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 120.861 -0.685 . . . . 0.0 113.265 -178.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 40.7 p -111.0 2.1 17.82 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 117.746 0.773 . . . . 0.0 112.956 176.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.3 mt -69.49 141.07 54.01 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 118.077 0.399 . . . . 0.0 111.192 -177.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -113.99 135.8 53.61 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.739 175.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 67.2 mt -119.38 158.34 26.35 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.986 0.422 . . . . 0.0 111.121 -175.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -149.68 141.53 23.73 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 176.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.0 t -105.69 109.17 21.04 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.196 -178.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -106.77 103.66 47.98 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 118.306 -0.854 . . . . 0.0 108.757 170.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -67.73 143.75 62.95 Favored 'Trans proline' 0 N--CA 1.499 1.81 0 CA-C-N 120.6 1.25 . . . . 0.0 111.955 -171.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -90.72 14.46 50.44 Favored 'Cis proline' 0 N--CA 1.501 1.916 0 CA-C-N 121.016 1.398 . . . . 0.0 113.518 -3.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -94.55 161.87 14.03 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 122.36 0.264 . . . . 0.0 110.411 -178.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 46.9 tp -114.93 132.89 56.4 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 172.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.479 HD11 ' CG2' ' A' ' 102' ' ' ILE . 8.6 tp -122.73 139.42 53.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.282 -173.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 48.7 p90 -142.93 154.62 44.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.826 0.346 . . . . 0.0 110.488 175.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.2 mtm180 -101.78 145.76 28.71 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.7 -178.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -127.68 164.77 21.35 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.659 0.743 . . . . 0.0 111.534 -176.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.7 tt0 -47.2 145.62 2.2 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.171 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 12.4 tpt180 65.28 30.91 10.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.322 -0.854 . . . . 0.0 112.019 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.0 t 64.93 35.27 8.41 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.896 0.379 . . . . 0.0 111.527 166.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 50.6 mtm180 -98.25 150.63 21.32 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 179.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.597 HD13 ' CH2' ' B' 1345 ' ' TRP . 74.2 mt -114.66 127.53 72.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 -178.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 -140.14 150.39 44.19 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.612 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.7 169.32 26.08 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 120.965 -0.636 . . . . 0.0 111.634 -175.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -125.22 137.3 54.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.389 -0.405 . . . . 0.0 110.4 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 42.7 t90 -107.18 127.53 53.6 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.6 176.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -114.54 146.15 41.09 Favored 'General case' 0 C--N 1.329 -0.294 0 O-C-N 123.223 0.327 . . . . 0.0 110.509 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -51.57 -36.35 44.97 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.627 177.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -134.08 134.85 42.79 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.416 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.7 t -61.2 -41.81 97.48 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.988 -177.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -59.88 -43.02 94.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.359 0.599 . . . . 0.0 110.176 179.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -56.98 -44.54 82.76 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.937 178.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 43.3 t -59.98 -38.71 83.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.698 177.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -59.1 -46.05 89.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.876 0.369 . . . . 0.0 110.502 -177.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 60.6 ttm-85 -59.79 -48.71 80.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.053 0.454 . . . . 0.0 110.579 -178.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.655 HG23 HD11 ' A' ' 54' ' ' ILE . 30.1 mm -58.33 -44.56 88.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.052 -179.002 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 53.3 p -59.4 -44.2 92.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.649 -177.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.78 -44.59 94.14 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.668 -0.973 . . . . 0.0 110.668 -178.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.516 HD13 ' HB2' ' A' ' 26' ' ' ASP . 10.4 mt -58.73 -48.34 81.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.114 0.483 . . . . 0.0 110.553 -178.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 50.6 t -58.9 -43.41 88.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.078 -178.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -57.4 -42.43 82.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.636 -178.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.33 -45.3 96.73 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.954 -0.858 . . . . 0.0 110.954 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.6 mt -57.82 -42.69 84.79 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.93 0.395 . . . . 0.0 110.524 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 86.9 mt -59.39 -41.73 90.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.636 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 15.0 pttm -95.5 11.22 33.74 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 67.5 m -119.95 145.73 46.48 Favored 'General case' 0 C--O 1.232 0.144 0 O-C-N 122.141 -0.349 . . . . 0.0 110.39 179.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 85.3 tttt . . . . . 0 C--O 1.219 -0.51 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.686 -179.645 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.364 0 N-CA-C 110.653 -0.979 . . . . 0.0 110.653 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -64.07 144.56 87.7 Favored 'Trans proline' 0 N--CA 1.496 1.648 0 CA-C-N 119.303 1.552 . . . . 0.0 111.906 -175.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -124.14 153.96 40.75 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.503 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -74.18 159.08 84.68 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.571 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -70.01 86.43 0.62 Allowed 'Trans proline' 0 N--CA 1.495 1.567 0 C-N-CA 121.24 1.293 . . . . 0.0 111.952 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 77.8 mt -62.74 -37.59 87.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.163 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 27.6 tp -75.9 132.55 40.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.872 0.368 . . . . 0.0 110.771 -178.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -115.3 151.8 33.9 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.229 178.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -60.58 -46.5 89.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.891 -178.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -148.98 160.26 43.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.666 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 93.0 mtm-85 -113.15 133.88 54.83 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.35 179.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.57 162.59 19.42 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.611 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -49.66 144.09 20.55 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 121.268 1.312 . . . . 0.0 112.015 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 53.2 m-85 -116.61 99.82 53.05 Favored Pre-proline 0 C--O 1.235 0.293 0 CA-C-O 119.125 -0.464 . . . . 0.0 110.53 -179.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -60.39 128.96 27.79 Favored 'Trans proline' 0 N--CA 1.496 1.657 0 C-N-CA 121.0 1.133 . . . . 0.0 111.355 178.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 99.79 -5.06 58.04 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 121.098 -0.572 . . . . 0.0 113.353 -178.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -52.05 143.49 13.86 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 118.252 1.026 . . . . 0.0 111.35 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 4.6 ttt -61.07 132.73 92.4 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-O 118.704 -0.665 . . . . 0.0 110.276 -178.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.93 160.95 44.84 Favored 'Trans proline' 0 N--CA 1.495 1.615 0 C-N-CA 121.234 1.289 . . . . 0.0 111.523 174.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -96.07 110.21 22.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.81 -179.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 16.8 mt -62.57 154.72 72.3 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.147 178.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -79.03 139.86 15.47 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 C-N-CA 121.227 1.285 . . . . 0.0 110.841 173.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -95.66 125.72 48.13 Favored Pre-proline 0 CA--C 1.534 0.354 0 CA-C-O 118.803 -0.618 . . . . 0.0 109.667 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -77.95 154.03 29.43 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 121.446 1.431 . . . . 0.0 111.643 173.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -58.47 154.2 43.27 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 121.313 1.342 . . . . 0.0 111.404 177.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1343 ' ' LEU . . . . . 0.532 ' H ' HD12 ' B' 1343 ' ' LEU . 6.2 mp -50.66 -30.5 13.73 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -176.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -55.88 -38.04 69.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.82 0.343 . . . . 0.0 111.188 -177.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1345 ' ' TRP . . . . . 0.597 ' CH2' HD13 ' A' ' 102' ' ' ILE . 7.6 t90 -61.92 -48.06 82.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.151 -177.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -60.4 -47.06 87.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.113 0.483 . . . . 0.0 110.519 -177.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -59.93 -45.38 92.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.794 -177.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -57.81 -45.15 86.53 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.539 -177.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.21 -48.26 82.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.577 -178.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -57.76 -42.01 83.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.951 -177.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -64.01 -48.42 76.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.022 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -55.18 -45.75 75.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.077 -178.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 42.1 tp10 -65.03 -37.01 86.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.005 179.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -158.0 146.12 18.75 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.763 0.316 . . . . 0.0 110.612 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 31.1 tp . . . . . 0 C--O 1.219 -0.509 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.482 179.68 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -67.88 153.8 74.56 Favored 'Trans proline' 0 N--CA 1.495 1.564 0 C-N-CA 121.28 1.32 . . . . 0.0 112.008 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -55.92 -39.85 72.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.934 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 45.0 ttm -82.82 123.35 29.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.625 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -146.51 154.23 41.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.465 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 18.5 p30 -76.2 153.97 35.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.709 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 29.5 tp -69.29 -39.43 78.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.838 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.4 mtp -64.73 116.49 6.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.621 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -174.56 125.44 0.3 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.557 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -78.94 85.64 4.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.556 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -67.11 -33.35 75.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.596 -179.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 24.8 m -56.5 -41.07 76.06 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.919 0.39 . . . . 0.0 110.759 -176.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.7 mm -60.66 -46.44 95.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.287 -178.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.5 m -59.12 -43.93 91.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.519 -177.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -59.64 -45.89 90.64 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.607 -178.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 66.0 mtt -58.26 -43.68 88.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.027 0.442 . . . . 0.0 110.347 -178.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -60.34 -48.56 81.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.35 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.642 ' HA ' HD12 ' A' ' 14' ' ' ILE . 9.4 tp -60.79 -33.6 73.23 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.051 -178.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.59 -49.57 74.74 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.647 0.261 . . . . 0.0 110.673 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.99 -41.97 88.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.015 0.436 . . . . 0.0 110.501 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.664 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 92.9 mt -54.22 -53.01 32.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.535 178.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -53.47 -21.75 6.77 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -58.26 -34.85 70.94 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.584 0.23 . . . . 0.0 111.542 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.747 HG21 ' CB ' ' A' ' 75' ' ' SER . 46.6 mm -113.05 -37.77 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 120.679 0.276 . . . . 0.0 110.815 -176.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.5 t0 -116.7 77.4 8.25 Favored Pre-proline 0 CA--C 1.536 0.416 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.469 -177.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -54.85 -20.41 22.39 Favored 'Trans proline' 0 N--CA 1.497 1.725 0 C-N-CA 121.505 1.47 . . . . 0.0 113.416 -177.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 44.9 p90 -92.8 15.9 13.63 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -174.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -89.68 124.69 34.82 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 173.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.9 mmtp -97.54 -40.52 8.6 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.827 -175.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -153.09 157.52 40.53 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.574 -0.45 . . . . 0.0 111.503 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 46.7 mt -95.36 138.45 21.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.068 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.5 t -91.4 -46.42 14.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.801 176.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.516 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.0 t0 -154.72 156.56 36.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.006 178.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.7 p -143.11 132.65 23.63 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.016 0.436 . . . . 0.0 110.986 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.7 t -108.79 128.08 54.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.869 177.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.3 m -54.62 -39.06 67.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.226 -172.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -151.53 126.61 9.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.223 0.535 . . . . 0.0 111.742 -178.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.43 HG21 ' HB3' ' A' ' 52' ' ' PHE . 97.5 t -145.19 140.38 22.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.472 -177.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.52 149.85 50.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.068 -178.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.472 ' HD2' HG21 ' A' ' 46' ' ' THR . 21.7 t80 -101.45 130.14 47.63 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.289 0.566 . . . . 0.0 111.649 -176.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.432 ' CD2' HD11 ' B' 1338 ' ' LEU . 44.4 m-85 -124.91 142.46 51.45 Favored 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.687 178.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 72.1 m -122.07 147.47 46.07 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 177.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -104.79 131.94 51.64 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.018 0.437 . . . . 0.0 110.268 175.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -104.44 116.45 32.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.885 178.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 86.4 p -68.47 -31.62 71.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.966 -177.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -62.79 -38.34 90.29 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 121.062 -0.255 . . . . 0.0 110.986 -177.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -93.89 -21.48 19.21 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 69.08 42.48 1.25 Allowed 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.246 0.546 . . . . 0.0 109.948 -178.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -153.12 166.38 32.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.124 -177.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -90.78 142.01 28.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.236 177.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -125.06 127.53 47.08 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 176.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -72.39 139.79 48.02 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 177.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.472 HG21 ' HD2' ' A' ' 33' ' ' PHE . 68.6 p -92.19 178.62 5.8 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.035 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -89.01 16.12 7.54 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.0 t -112.29 106.4 20.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-O 120.946 0.403 . . . . 0.0 110.557 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -129.75 111.25 12.46 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 173.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.67 176.61 38.97 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 120.112 -1.042 . . . . 0.0 112.157 -168.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.454 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.33 137.0 37.83 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 175.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.43 ' HB3' HG21 ' A' ' 31' ' ' VAL . 5.4 t80 -100.06 127.69 46.25 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.219 -176.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.454 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 7.1 m-85 -130.78 142.9 50.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.653 0.263 . . . . 0.0 110.319 177.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.688 HD11 HG23 ' A' ' 116' ' ' ILE . 67.4 mt -101.5 127.77 54.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 172.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.664 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.2 m-30 -108.48 137.32 46.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.939 0.4 . . . . 0.0 111.262 -175.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 50.3 t60 -117.58 143.34 46.21 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.364 -0.834 . . . . 0.0 110.143 176.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 51.4 ttt85 -139.85 147.53 40.81 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.8 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -86.91 28.14 0.93 Allowed 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.6 157.74 32.54 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -63.88 135.27 96.22 Favored Pre-proline 0 CA--C 1.539 0.553 0 CA-C-O 118.571 -0.728 . . . . 0.0 110.208 -176.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -66.71 140.86 51.98 Favored 'Cis proline' 0 N--CA 1.5 1.869 0 CA-C-N 121.66 1.629 . . . . 0.0 111.275 -3.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -68.14 -42.9 79.45 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.163 -176.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.431 ' CD2' HD22 ' A' ' 123' ' ' LEU . 74.6 m80 -143.03 140.58 31.04 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.622 0.725 . . . . 0.0 111.057 -176.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.8 t -150.08 152.31 34.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.056 -177.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 46.3 mt -111.48 137.71 42.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -178.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -131.83 142.03 49.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.042 -176.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.0 mt -123.44 133.75 68.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.195 0.521 . . . . 0.0 109.872 172.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -101.45 99.93 10.32 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.556 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -72.62 109.0 5.95 Favored 'General case' 0 C--N 1.331 -0.222 0 O-C-N 123.655 0.597 . . . . 0.0 111.037 -175.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -74.4 -40.39 62.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.2 -171.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 54.7 mt -71.19 -45.0 64.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.613 -175.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 53.2 m-20 -95.1 -3.13 48.64 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -175.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.3 p 51.17 42.2 28.51 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.439 0.638 . . . . 0.0 111.092 178.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 42.9 m -127.96 149.07 50.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.153 -0.93 . . . . 0.0 109.729 179.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.747 ' CB ' HG21 ' A' ' 17' ' ' ILE . 49.0 p -102.28 144.99 30.09 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.923 0.392 . . . . 0.0 111.161 -177.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -138.38 122.16 17.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.301 177.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 p -125.43 148.38 29.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.53 -0.304 . . . . 0.0 111.061 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 56.4 tt0 -146.44 136.46 11.96 Favored Pre-proline 0 CA--C 1.537 0.48 0 CA-C-O 118.992 -0.528 . . . . 0.0 110.507 175.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.4 150.92 37.14 Favored 'Trans proline' 0 N--CA 1.498 1.771 0 C-N-CA 121.615 1.544 . . . . 0.0 112.484 179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 71.3 mt -90.51 137.26 21.97 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-O 120.916 0.389 . . . . 0.0 110.317 177.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.9 p -132.18 155.39 48.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.708 177.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.555 ' HA2' HD22 ' A' ' 124' ' ' LEU . . . -96.45 32.0 6.92 Favored Glycine 0 CA--C 1.527 0.789 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.331 -178.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 63.4 p -100.85 -26.01 13.91 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 173.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.9 mt -69.01 147.35 51.72 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 120.889 0.375 . . . . 0.0 111.317 -176.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -116.2 135.84 53.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.638 175.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.3 mt -109.18 159.64 16.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.208 -174.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -148.9 141.36 24.26 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 178.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.8 t -98.82 109.21 22.0 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.725 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -106.85 103.61 48.0 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 172.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -71.32 139.65 35.39 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 CA-C-N 120.613 1.255 . . . . 0.0 112.012 -171.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -89.36 9.48 64.28 Favored 'Cis proline' 0 N--CA 1.5 1.897 0 CA-C-N 121.267 1.488 . . . . 0.0 113.737 -3.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -84.99 170.72 12.74 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.72 0.295 . . . . 0.0 110.858 -177.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 61.8 tp -118.75 132.75 56.15 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 170.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.8 tp -124.16 140.06 53.33 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.538 0.208 . . . . 0.0 110.583 -173.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 20.5 p90 -145.72 149.89 35.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.851 0.358 . . . . 0.0 110.562 175.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 54.5 mtm180 -106.71 148.17 28.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 -177.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -129.56 165.02 22.55 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.837 0.827 . . . . 0.0 111.433 -176.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -47.92 148.15 1.77 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.219 -177.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 54.7 ttt180 65.33 30.8 10.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.019 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 31.8 m 65.19 35.24 7.93 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.795 0.331 . . . . 0.0 111.575 165.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -99.74 145.95 27.09 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.45 HG21 ' CH2' ' B' 1345 ' ' TRP . 85.2 mt -113.7 130.36 67.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.114 0.483 . . . . 0.0 109.81 -178.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -137.91 147.71 44.65 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.433 177.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.91 168.16 25.73 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 111.373 -0.691 . . . . 0.0 111.373 -176.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -125.2 140.41 52.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.803 0.335 . . . . 0.0 110.803 -179.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 21.9 t90 -106.89 123.82 48.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.584 175.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -113.33 141.55 46.89 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.824 0.345 . . . . 0.0 110.519 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -51.31 -35.82 39.64 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.672 178.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 -135.57 135.98 40.74 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.33 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 82.7 p -63.39 -40.23 96.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.144 -177.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -60.65 -43.3 97.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.356 0.598 . . . . 0.0 110.096 178.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -56.73 -45.8 81.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.563 0.697 . . . . 0.0 109.928 178.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 47.7 t -60.09 -38.13 82.01 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.811 178.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -59.48 -46.6 88.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.863 0.363 . . . . 0.0 110.514 -177.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 72.2 mtm180 -60.07 -48.16 82.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.008 0.433 . . . . 0.0 110.646 -177.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.688 HG23 HD11 ' A' ' 54' ' ' ILE . 28.9 mm -58.42 -44.94 89.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.072 -178.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.2 p -59.31 -44.3 92.57 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.679 -177.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.48 -44.42 93.71 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -178.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.516 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.3 mt -58.59 -48.41 81.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.185 0.517 . . . . 0.0 110.471 -178.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.508 HG12 HD11 ' A' ' 124' ' ' LEU . 54.3 t -58.63 -43.52 87.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.185 -178.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.8 m120 -58.2 -42.66 86.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.745 -178.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.97 -42.94 99.77 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.409 -0.676 . . . . 0.0 111.409 -178.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.431 HD22 ' CD2' ' A' ' 63' ' ' HIS . 50.1 mt -64.1 -43.27 95.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.759 0.314 . . . . 0.0 111.303 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.555 HD22 ' HA2' ' A' ' 82' ' ' GLY . 24.0 mt -63.74 -45.01 91.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.385 -176.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -70.81 -38.18 73.28 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.826 -0.35 . . . . 0.0 111.168 -177.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 67.7 p -88.28 158.58 18.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.54 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt . . . . . 0 C--O 1.221 -0.438 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.571 179.922 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.299 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -50.71 141.74 34.03 Favored 'Trans proline' 0 N--CA 1.494 1.554 0 CA-C-N 118.802 1.301 . . . . 0.0 112.031 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -111.51 148.7 32.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.5 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -67.69 153.45 95.04 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.514 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -75.82 130.34 12.38 Favored 'Trans proline' 0 N--CA 1.494 1.554 0 C-N-CA 121.253 1.302 . . . . 0.0 112.072 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 79.7 mt -63.33 -40.24 96.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.709 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1324 ' ' LEU . . . . . 0.51 ' N ' HD12 ' B' 1324 ' ' LEU . 6.8 mp -102.41 137.42 40.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.515 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -100.05 125.61 46.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.566 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -59.07 -40.07 84.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.828 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -95.23 137.56 34.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.561 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 25.8 mmt180 -103.62 132.51 49.81 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.399 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.57 164.48 14.64 Favored Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.491 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -49.26 151.9 6.01 Favored 'Trans proline' 0 N--CA 1.495 1.577 0 C-N-CA 121.326 1.351 . . . . 0.0 112.094 179.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -107.39 99.88 30.57 Favored Pre-proline 0 CA--C 1.534 0.345 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.516 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -57.91 128.97 31.03 Favored 'Trans proline' 0 N--CA 1.496 1.636 0 C-N-CA 121.054 1.169 . . . . 0.0 111.674 178.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 76.74 19.9 77.14 Favored Glycine 0 CA--C 1.532 1.136 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.91 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -53.72 141.63 25.94 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 117.883 0.842 . . . . 0.0 111.087 177.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 8.3 ttt -65.93 118.06 48.36 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-O 118.703 -0.665 . . . . 0.0 110.574 -178.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -65.09 156.97 59.86 Favored 'Trans proline' 0 N--CA 1.498 1.74 0 C-N-CA 121.121 1.214 . . . . 0.0 111.397 172.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 38.9 t30 -97.36 110.59 23.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.932 -178.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1338 ' ' LEU . . . . . 0.432 HD11 ' CD2' ' A' ' 34' ' ' TYR . 11.6 mt -66.12 152.1 94.43 Favored Pre-proline 0 C--N 1.33 -0.26 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 177.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.1 139.61 15.18 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 121.083 1.189 . . . . 0.0 111.084 174.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -97.14 125.9 44.14 Favored Pre-proline 0 CA--C 1.535 0.396 0 CA-C-O 118.442 -0.789 . . . . 0.0 110.007 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -78.17 168.97 21.02 Favored 'Trans proline' 0 N--CA 1.496 1.643 0 C-N-CA 121.315 1.343 . . . . 0.0 111.734 176.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.91 152.55 57.12 Favored 'Trans proline' 0 N--CA 1.495 1.609 0 C-N-CA 121.268 1.312 . . . . 0.0 111.344 177.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1343 ' ' LEU . . . . . 0.534 ' H ' HD12 ' B' 1343 ' ' LEU . 6.1 mp -49.97 -25.23 3.12 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -176.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 84.9 m-85 -55.34 -37.65 67.73 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.742 0.306 . . . . 0.0 111.167 -176.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1345 ' ' TRP . . . . . 0.45 ' CH2' HG21 ' A' ' 102' ' ' ILE . 58.2 t90 -61.78 -48.1 82.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.406 -176.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -62.01 -49.55 75.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.981 0.42 . . . . 0.0 110.52 -176.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -60.9 -46.05 92.18 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.083 -175.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 42.4 tp10 -59.29 -46.85 87.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.72 -175.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -61.58 -50.75 71.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.891 -176.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -59.43 -42.03 90.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.373 -175.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 82.4 tttt -68.04 -49.75 59.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.519 -176.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -58.52 -49.0 78.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.59 -175.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -73.07 -37.07 66.94 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.923 -0.311 . . . . 0.0 111.351 -177.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -124.64 127.39 47.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.8 0.333 . . . . 0.0 110.748 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 78.1 mt . . . . . 0 C--O 1.221 -0.427 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.543 179.852 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.298 0 N-CA-C 109.604 -1.398 . . . . 0.0 109.604 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -86.92 30.54 0.47 Allowed 'Trans proline' 0 N--CA 1.491 1.359 0 C-N-CA 121.636 1.557 . . . . 0.0 112.514 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -59.12 -41.32 87.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.759 0.314 . . . . 0.0 110.593 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 85.4 mtp -88.75 143.51 26.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.594 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -99.07 145.54 27.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.544 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 77.1 m-20 -67.62 143.24 56.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.561 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 78.5 mt -57.98 -40.03 79.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.767 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.8 mtp -86.38 134.13 33.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.496 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -87.78 117.99 27.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.571 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -83.46 154.4 23.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.438 179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -59.82 -38.74 82.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.839 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.0 p -57.7 -41.63 82.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.975 0.417 . . . . 0.0 110.435 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.2 mm -59.75 -44.14 93.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.108 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 32.7 m -59.44 -45.18 92.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.534 -177.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.3 tpt180 -59.05 -45.96 89.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.369 -178.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.5 mtt -58.14 -43.92 87.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.188 0.518 . . . . 0.0 110.387 -177.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -59.95 -49.46 77.61 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.189 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.74 ' HA ' HD12 ' A' ' 14' ' ' ILE . 10.8 tp -58.79 -33.69 70.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.988 -178.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.05 -50.94 68.65 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.659 0.266 . . . . 0.0 110.891 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.85 -41.55 82.61 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.967 0.413 . . . . 0.0 110.5 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.74 HD12 ' HA ' ' A' ' 11' ' ' LEU . 88.8 mt -54.31 -52.93 34.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.627 178.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -51.43 -24.17 4.67 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt -58.56 -34.11 70.68 Favored 'General case' 0 CA--C 1.529 0.141 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 -177.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.697 HG21 ' CB ' ' A' ' 75' ' ' SER . 43.7 mm -110.22 -42.05 4.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.79 0.329 . . . . 0.0 110.239 -177.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -116.25 79.23 8.6 Favored Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.137 -178.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -53.86 -19.96 16.45 Favored 'Trans proline' 0 N--CA 1.497 1.717 0 C-N-CA 121.54 1.493 . . . . 0.0 113.498 -176.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.3 p90 -95.96 15.23 21.08 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -174.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -91.65 126.59 36.79 Favored 'General case' 0 C--N 1.333 -0.121 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 173.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.614 ' O ' HD21 ' A' ' 11' ' ' LEU . 27.6 ttmt -109.34 -38.0 5.6 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 120.835 -0.346 . . . . 0.0 111.37 -172.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -132.81 145.54 51.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.962 0.41 . . . . 0.0 111.157 -175.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.427 HD11 HD12 ' A' ' 14' ' ' ILE . 19.2 mt -100.45 133.44 43.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 171.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.1 t -90.57 -47.06 14.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.987 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.503 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.0 t0 -153.82 156.08 37.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.994 179.062 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 8.7 p -142.57 132.05 23.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.102 0.477 . . . . 0.0 110.917 179.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.0 t -108.52 127.37 53.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.731 177.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 86.9 p -54.78 -38.24 67.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.28 -172.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -151.19 126.36 9.91 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.215 0.531 . . . . 0.0 111.764 -178.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.422 HG21 ' HB3' ' A' ' 52' ' ' PHE . 97.3 t -145.28 140.12 22.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.32 -177.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -130.22 149.85 51.73 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.17 -177.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.514 ' CD2' HG21 ' A' ' 46' ' ' THR . 11.0 t80 -96.85 133.55 41.32 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.313 0.578 . . . . 0.0 111.638 -176.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -125.77 140.91 52.29 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.404 177.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 86.2 m -123.0 144.06 49.51 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 177.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -105.31 130.24 53.48 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.901 0.381 . . . . 0.0 110.155 175.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -101.56 115.52 30.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.785 176.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.5 m -67.48 -33.18 74.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.895 -177.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.3 m -61.54 -38.08 86.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.631 0.253 . . . . 0.0 111.021 -177.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -94.92 -21.37 18.69 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 22.5 t30 68.99 45.44 0.92 Allowed 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.519 0.676 . . . . 0.0 109.558 -177.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 74.5 tt0 -155.96 151.63 27.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.203 -177.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 88.8 m95 -84.32 142.46 30.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.123 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -125.02 131.49 53.38 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.01 -0.366 . . . . 0.0 110.01 176.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 55.8 pttt -74.87 136.79 41.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.277 178.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.514 HG21 ' CD2' ' A' ' 33' ' ' PHE . 72.4 p -92.31 168.46 11.3 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.775 -0.37 . . . . 0.0 110.285 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -74.22 -18.49 60.74 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.5 t -75.51 106.39 5.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-O 121.042 0.448 . . . . 0.0 110.457 -178.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -133.29 110.95 10.43 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 174.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.61 176.54 38.92 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 120.277 -0.963 . . . . 0.0 112.252 -168.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.462 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.39 135.48 37.45 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 174.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.422 ' HB3' HG21 ' A' ' 31' ' ' VAL . 5.3 t80 -99.12 127.48 45.08 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.134 -176.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.462 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 7.1 m-85 -130.72 142.4 50.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.297 177.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.674 HD11 HG23 ' A' ' 116' ' ' ILE . 66.5 mt -101.54 127.51 54.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 172.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.667 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.8 m-30 -108.47 136.22 48.46 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.994 0.426 . . . . 0.0 111.394 -175.27 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 79.0 t60 -112.05 143.34 43.22 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.247 174.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.7 ttt180 -142.01 146.58 35.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.041 178.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -86.89 28.04 0.94 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.267 -0.424 . . . . 0.0 112.081 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.6 169.53 24.21 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -64.02 125.29 87.67 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-O 118.441 -0.79 . . . . 0.0 110.018 -178.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -78.39 141.0 63.19 Favored 'Cis proline' 0 N--CA 1.497 1.677 0 CA-C-N 121.92 1.721 . . . . 0.0 111.831 -1.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -64.9 -41.5 95.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.993 -177.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -142.71 136.97 29.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.365 0.602 . . . . 0.0 110.935 -177.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.1 t -150.55 152.35 34.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.38 -178.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.419 HG13 HD11 ' A' ' 80' ' ' ILE . 43.0 mt -111.15 138.44 39.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 -178.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -131.88 142.0 49.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.955 -176.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 62.8 mt -123.5 132.76 70.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.255 0.55 . . . . 0.0 109.784 172.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -99.15 99.52 10.52 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.234 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 56.8 t-20 -76.56 107.82 9.1 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 121.748 0.785 . . . . 0.0 110.86 -174.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 60.7 ttm-85 -73.41 -35.98 65.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.208 -0.906 . . . . 0.0 111.516 -170.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.6 mt -71.47 -45.35 62.78 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.999 -173.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 42.1 p-10 -95.2 -3.35 47.9 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -177.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.7 m 58.32 44.25 18.8 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 121.497 0.665 . . . . 0.0 109.97 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 29.3 m -134.35 149.06 50.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.224 -177.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.697 ' CB ' HG21 ' A' ' 17' ' ' ILE . 10.8 p -101.85 144.99 29.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.283 -177.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -137.31 122.24 18.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.444 177.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 13.0 p -125.42 149.22 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-O 120.933 0.397 . . . . 0.0 111.177 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -147.83 131.35 8.26 Favored Pre-proline 0 CA--C 1.538 0.513 0 CA-C-O 118.747 -0.644 . . . . 0.0 110.241 176.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -75.35 150.84 37.25 Favored 'Trans proline' 0 N--CA 1.5 1.872 0 C-N-CA 121.475 1.45 . . . . 0.0 112.432 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.419 HD11 HG13 ' A' ' 65' ' ' ILE . 62.5 mt -90.69 123.01 42.67 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-O 120.846 0.355 . . . . 0.0 110.488 179.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 73.0 p -99.66 154.61 18.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.869 174.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -92.69 24.14 25.1 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.868 -179.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 38.8 p -111.03 -9.91 14.38 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 175.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.9 mt -67.74 140.39 56.72 Favored 'General case' 0 C--O 1.232 0.142 0 O-C-N 122.112 -0.367 . . . . 0.0 111.275 -176.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.9 tt0 -113.48 135.81 53.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.853 176.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 61.3 mt -113.61 161.31 17.59 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.75 -176.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -149.99 143.71 25.37 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 33.3 t -99.69 109.25 21.73 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.536 -0.466 . . . . 0.0 110.515 179.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -106.75 103.75 48.29 Favored Pre-proline 0 C--N 1.329 -0.321 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 173.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -67.92 140.1 49.36 Favored 'Trans proline' 0 N--CA 1.496 1.647 0 CA-C-N 120.403 1.179 . . . . 0.0 111.784 -172.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -89.76 9.24 64.61 Favored 'Cis proline' 0 N--CA 1.5 1.899 0 CA-C-N 121.239 1.478 . . . . 0.0 113.699 -5.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -89.58 172.79 8.71 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.607 0.241 . . . . 0.0 110.815 -176.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 57.8 tp -115.95 136.38 53.1 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 172.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 11.6 tp -129.5 140.64 51.2 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.617 0.246 . . . . 0.0 110.654 -174.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -146.39 157.32 43.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.808 0.337 . . . . 0.0 110.418 175.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.4 mtm105 -101.88 144.79 30.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.629 -177.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -127.49 163.02 25.03 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.951 0.881 . . . . 0.0 111.854 -176.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -47.77 149.98 1.16 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.36 -0.837 . . . . 0.0 112.177 -177.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 93.0 mtt180 62.21 30.8 17.72 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.158 -0.928 . . . . 0.0 112.102 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 69.6 m 65.74 35.23 6.97 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.866 0.365 . . . . 0.0 111.487 165.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 68.1 mtp180 -101.23 151.37 21.94 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 78.5 mt -111.37 126.75 68.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 -178.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 32.9 mtp180 -130.82 145.35 51.96 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.658 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -140.84 167.98 25.44 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -127.96 141.71 51.45 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.952 0.406 . . . . 0.0 110.882 -178.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 70.8 t90 -106.72 124.67 49.95 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.518 175.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -114.01 140.43 48.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.677 0.275 . . . . 0.0 110.512 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 68.9 t80 -51.7 -36.72 47.84 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.665 178.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 37.3 t-20 -134.46 135.66 42.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.438 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.3 m -61.22 -42.05 97.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.07 -177.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -59.85 -43.4 94.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.399 0.619 . . . . 0.0 110.136 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -56.78 -44.87 82.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.49 0.662 . . . . 0.0 110.079 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 45.9 t -59.7 -39.83 85.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.673 178.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -58.79 -44.86 90.83 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.848 0.356 . . . . 0.0 110.669 -177.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -60.79 -49.79 76.07 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.73 -177.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.674 HG23 HD11 ' A' ' 54' ' ' ILE . 32.9 mm -58.47 -44.57 89.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.051 0.453 . . . . 0.0 109.982 -178.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 60.1 p -59.79 -44.16 94.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.677 -177.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.66 -43.69 94.28 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.67 -0.972 . . . . 0.0 110.67 -178.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.503 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.1 mt -59.18 -49.01 79.49 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.118 0.485 . . . . 0.0 110.617 -178.308 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 53.8 t -58.9 -43.51 88.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.083 -178.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -58.03 -42.52 85.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.865 0.364 . . . . 0.0 110.674 -178.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.97 -41.47 99.66 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 -179.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 36.3 mt -62.5 -43.16 99.5 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.878 0.371 . . . . 0.0 111.119 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 79.9 mt -64.14 -44.89 90.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.618 -176.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 49.4 pttt -70.84 -36.97 73.11 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.301 -177.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 55.0 p -62.44 162.88 9.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.776 0.322 . . . . 0.0 110.514 -179.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 99.3 mttt . . . . . 0 C--O 1.221 -0.442 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.5 -179.802 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.29 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.59 141.93 56.99 Favored 'Trans proline' 0 N--CA 1.495 1.612 0 C-N-CA 121.33 1.353 . . . . 0.0 111.883 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -118.34 151.14 38.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.46 -179.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -68.36 158.22 85.39 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.493 179.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -61.93 -32.25 84.76 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 121.268 1.312 . . . . 0.0 112.058 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 78.7 mt -58.91 -41.84 88.19 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.538 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.0 mt -65.98 -38.81 89.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.044 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -56.82 -40.51 76.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.874 -179.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -64.27 -46.11 85.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.876 -179.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -144.99 147.32 32.51 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.719 -179.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 41.4 tpt85 -101.38 111.93 24.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.371 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.65 155.17 41.03 Favored Pre-proline 0 CA--C 1.532 0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.459 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -51.89 142.89 41.38 Favored 'Trans proline' 0 N--CA 1.494 1.555 0 C-N-CA 121.288 1.325 . . . . 0.0 111.854 179.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 4.3 t80 -72.22 114.31 28.32 Favored Pre-proline 0 CA--C 1.536 0.429 0 CA-C-O 118.796 -0.621 . . . . 0.0 110.132 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -57.94 129.87 35.44 Favored 'Trans proline' 0 N--CA 1.496 1.643 0 CA-C-N 120.383 1.172 . . . . 0.0 111.582 -178.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 105.06 -5.09 41.85 Favored Glycine 0 CA--C 1.535 1.296 0 CA-C-O 119.439 -0.645 . . . . 0.0 113.38 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -75.22 118.02 17.67 Favored 'General case' 0 C--O 1.23 0.078 0 CA-C-N 118.417 1.108 . . . . 0.0 110.209 174.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 8.5 ttt -93.06 118.09 67.71 Favored Pre-proline 0 CA--C 1.534 0.362 0 CA-C-O 118.662 -0.685 . . . . 0.0 110.525 -178.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.03 143.16 74.75 Favored 'Trans proline' 0 N--CA 1.497 1.692 0 C-N-CA 121.064 1.176 . . . . 0.0 111.487 173.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 42.5 t30 -97.66 108.76 21.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.712 -179.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 13.2 mt -79.76 145.92 63.38 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-O 119.04 -0.505 . . . . 0.0 109.762 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -79.19 139.93 15.25 Favored 'Trans proline' 0 N--CA 1.493 1.475 0 C-N-CA 121.178 1.252 . . . . 0.0 111.33 175.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 25.4 mmtp -97.16 125.69 44.87 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-O 118.85 -0.595 . . . . 0.0 109.798 178.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 9.4 Cg_exo -74.18 158.32 45.39 Favored 'Trans proline' 0 N--CA 1.497 1.732 0 C-N-CA 121.464 1.442 . . . . 0.0 112.11 172.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -53.63 157.11 10.3 Favored 'Trans proline' 0 N--CA 1.496 1.639 0 C-N-CA 121.381 1.387 . . . . 0.0 111.932 178.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 80.7 mt -49.98 -28.17 6.48 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -177.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -54.74 -37.58 66.09 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.922 0.391 . . . . 0.0 111.126 -177.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 41.9 t90 -60.85 -47.96 84.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.244 -178.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -59.93 -46.65 88.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.992 0.425 . . . . 0.0 110.307 -177.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -59.23 -45.97 89.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.661 -177.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -57.74 -44.71 86.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.573 -177.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.19 -47.56 85.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.673 -177.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -57.69 -42.91 84.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.828 -177.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 63.9 tttm -64.74 -48.15 75.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.188 -177.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -55.04 -46.53 75.31 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.244 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -64.91 -37.1 86.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.191 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -148.47 136.55 21.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.89 0.376 . . . . 0.0 110.794 -179.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 78.7 mt . . . . . 0 C--O 1.219 -0.501 0 CA-C-O 118.001 -0.999 . . . . 0.0 110.541 179.84 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.314 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.87 134.13 34.65 Favored 'Trans proline' 0 N--CA 1.495 1.601 0 CA-C-N 118.897 1.349 . . . . 0.0 112.072 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -82.13 -39.75 22.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.87 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 85.5 mtp -81.64 160.91 23.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.664 -179.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -58.89 150.75 23.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.653 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -79.45 102.16 8.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.645 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 78.5 mt -77.16 -40.09 46.68 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.836 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.0 mtp -102.54 160.32 14.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.674 -178.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -60.33 146.58 43.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.62 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -98.09 168.28 10.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.595 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -60.07 -36.84 78.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.066 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.4 m -57.0 -41.16 77.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.924 0.393 . . . . 0.0 110.498 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.3 mm -59.64 -44.76 94.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.088 -179.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.4 m -59.25 -45.2 91.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.986 0.422 . . . . 0.0 110.481 -177.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.0 mmt180 -58.99 -45.72 89.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.468 -178.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.8 mtt -58.26 -43.79 88.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.121 0.486 . . . . 0.0 110.44 -178.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -59.28 -48.37 81.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.21 -178.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.651 ' HA ' HD12 ' A' ' 14' ' ' ILE . 9.4 tp -60.36 -33.39 72.36 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.146 -179.274 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.91 -49.77 74.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.677 0.275 . . . . 0.0 110.662 179.273 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.06 -41.95 89.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.974 0.416 . . . . 0.0 110.434 179.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.658 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 93.5 mt -54.28 -52.85 34.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.627 178.349 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -51.85 -27.29 12.13 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -177.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -58.94 -32.81 69.93 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -177.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.1 mm -106.17 -44.95 8.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.026 0.441 . . . . 0.0 110.064 -177.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -117.12 79.16 10.56 Favored Pre-proline 0 CA--C 1.535 0.4 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.276 -177.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -54.32 -20.22 19.29 Favored 'Trans proline' 0 N--CA 1.497 1.721 0 C-N-CA 121.473 1.449 . . . . 0.0 113.561 -175.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 14.5 p90 -93.52 15.13 16.74 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -174.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -81.28 128.12 33.46 Favored 'General case' 0 C--N 1.334 -0.1 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 173.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -97.51 -40.36 8.7 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.704 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -159.03 159.88 35.22 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.679 -0.409 . . . . 0.0 111.408 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 39.8 mt -96.22 138.39 21.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.052 178.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.9 t -90.87 -47.21 14.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.856 176.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.497 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.0 t0 -154.0 158.13 40.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.933 178.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 18.6 p -143.89 133.24 23.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.971 0.415 . . . . 0.0 111.153 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.3 t -110.12 127.8 55.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.74 177.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.4 m -54.86 -39.75 68.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.206 -171.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -149.81 125.91 10.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.262 0.553 . . . . 0.0 111.818 -178.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.442 HG21 ' HB3' ' A' ' 52' ' ' PHE . 97.2 t -145.19 142.25 22.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.447 -177.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.59 149.84 51.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.164 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -99.01 131.43 45.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.233 0.539 . . . . 0.0 111.519 -177.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -125.82 144.23 50.73 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.807 179.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 80.4 m -121.32 148.56 44.17 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 177.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -109.8 130.84 55.48 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.874 0.368 . . . . 0.0 110.452 176.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 36.9 t-20 -101.07 113.0 25.6 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.834 176.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.1 m -67.5 -32.73 73.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.976 -177.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.5 m -62.31 -38.52 89.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.666 0.269 . . . . 0.0 111.043 -177.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -94.72 -21.41 18.77 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -178.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 27.2 t30 68.74 45.76 0.99 Allowed 'General case' 0 C--O 1.233 0.223 0 CA-C-O 121.485 0.659 . . . . 0.0 109.356 -177.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -151.42 151.23 31.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.07 -176.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.42 ' CB ' HD12 ' B' 1338 ' ' LEU . 81.0 m95 -87.65 141.28 28.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.341 177.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -125.02 130.47 52.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.17 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -76.47 139.93 41.03 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.9 p -92.31 177.42 6.15 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.13 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.7 p30 -86.98 12.96 10.02 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.9 t -106.62 106.44 20.62 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-O 120.988 0.423 . . . . 0.0 110.377 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -130.1 112.55 13.53 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 174.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.56 38.96 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 120.157 -1.02 . . . . 0.0 112.148 -168.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.456 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -79.77 135.42 36.49 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 175.383 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.442 ' HB3' HG21 ' A' ' 31' ' ' VAL . 6.3 t80 -98.27 129.22 44.99 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.113 -176.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.456 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.6 m-85 -132.57 143.4 49.68 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.103 177.4 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.718 HD11 HG23 ' A' ' 116' ' ' ILE . 69.9 mt -101.57 128.12 54.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 172.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.658 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 13.4 m-30 -108.42 135.91 48.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.991 0.424 . . . . 0.0 111.247 -175.011 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 83.4 t60 -116.37 143.35 45.66 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.917 176.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -141.98 148.18 38.16 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.121 179.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -86.82 28.06 0.93 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 116.264 -0.426 . . . . 0.0 112.059 179.174 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.72 162.57 38.57 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 24.8 mp0 -64.06 130.7 94.67 Favored Pre-proline 0 CA--C 1.539 0.535 0 CA-C-O 118.517 -0.754 . . . . 0.0 110.031 -177.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.46 140.93 69.28 Favored 'Cis proline' 0 N--CA 1.498 1.739 0 CA-C-N 121.795 1.677 . . . . 0.0 111.63 -1.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -65.6 -42.69 91.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.04 -177.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.409 ' CD2' HD22 ' A' ' 123' ' ' LEU . 65.4 m80 -141.8 139.04 32.64 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.426 0.631 . . . . 0.0 110.917 -176.526 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.2 t -150.79 151.96 33.11 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.294 -178.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.7 mt -108.33 139.14 31.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -179.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.402 ' CD2' HG22 ' A' ' 77' ' ' VAL . 32.8 t80 -131.8 141.99 49.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.741 -176.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.0 mt -127.15 129.96 71.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-O 121.204 0.526 . . . . 0.0 110.048 173.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -96.17 99.52 11.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.539 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.2 t-20 -71.12 105.23 3.3 Favored 'General case' 0 C--N 1.332 -0.182 0 O-C-N 123.66 0.6 . . . . 0.0 110.8 -176.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 77.0 mtp85 -73.58 -38.62 65.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.489 -170.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 62.8 mt -75.15 -45.2 42.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.658 -174.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -95.13 -3.26 48.28 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 -175.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.427 HG22 ' O ' ' A' ' 73' ' ' THR . 11.9 m 54.89 43.11 30.48 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 121.441 0.638 . . . . 0.0 110.652 177.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.3 m -125.98 148.63 49.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.579 -177.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 76.2 p -94.74 130.27 41.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.127 -179.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -123.51 122.27 37.78 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 174.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.402 HG22 ' CD2' ' A' ' 66' ' ' PHE . 39.5 t -125.53 147.05 30.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.796 -176.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -146.6 126.45 6.77 Favored Pre-proline 0 CA--C 1.539 0.554 0 CA-C-O 118.683 -0.675 . . . . 0.0 110.37 174.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -75.37 150.89 37.24 Favored 'Trans proline' 0 N--CA 1.498 1.762 0 C-N-CA 121.471 1.447 . . . . 0.0 112.418 178.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 67.3 mt -93.59 138.78 19.55 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 CA-C-O 120.967 0.413 . . . . 0.0 110.263 178.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.429 ' OG1' HD23 ' A' ' 84' ' ' LEU . 60.2 p -132.17 157.16 44.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.688 177.019 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -90.91 31.81 5.43 Favored Glycine 0 CA--C 1.528 0.854 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.296 -178.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 54.5 p -111.07 -17.99 13.13 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 174.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.429 HD23 ' OG1' ' A' ' 81' ' ' THR . 4.5 mm? -67.82 141.52 56.46 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-O 120.926 0.393 . . . . 0.0 110.976 -175.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.7 tt0 -111.96 135.91 51.98 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.661 175.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 68.9 mt -115.39 156.92 24.67 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.945 0.402 . . . . 0.0 110.984 -176.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -148.85 142.4 25.39 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 177.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.0 t -99.05 109.14 21.91 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.668 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -106.8 103.71 48.3 Favored Pre-proline 0 C--N 1.328 -0.34 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 172.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -70.03 140.3 41.34 Favored 'Trans proline' 0 N--CA 1.497 1.699 0 CA-C-N 120.468 1.203 . . . . 0.0 112.013 -171.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -89.8 9.92 62.85 Favored 'Cis proline' 0 N--CA 1.501 1.922 0 CA-C-N 121.317 1.506 . . . . 0.0 113.756 -4.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -88.22 170.21 11.21 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.694 0.283 . . . . 0.0 110.981 -177.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 55.9 tp -116.55 133.77 55.62 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 171.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.484 HD11 ' CG2' ' A' ' 102' ' ' ILE . 10.7 tp -125.37 139.09 53.98 Favored 'General case' 0 C--N 1.333 -0.137 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 -174.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -143.93 151.96 40.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.998 0.428 . . . . 0.0 110.65 175.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 30.3 mtm180 -104.47 144.09 32.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.668 -177.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -129.09 166.5 19.15 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.917 0.865 . . . . 0.0 111.811 -176.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -47.7 148.29 1.58 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.312 -0.858 . . . . 0.0 112.279 -176.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 63.41 30.85 15.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.126 -0.943 . . . . 0.0 112.256 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 67.3 m 65.67 35.25 7.08 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.848 0.356 . . . . 0.0 111.526 166.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 27.7 mmt180 -99.26 145.9 26.78 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.708 HD13 ' CH2' ' B' 1345 ' ' TRP . 82.7 mt -114.93 127.47 72.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 121.088 0.47 . . . . 0.0 109.792 -178.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -136.78 150.33 48.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.506 179.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.52 169.47 25.13 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 111.41 -0.676 . . . . 0.0 111.41 -175.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -125.21 138.56 54.12 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.998 0.428 . . . . 0.0 110.625 -178.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -106.45 120.37 41.74 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.893 -1.049 . . . . 0.0 109.583 177.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -112.77 139.75 48.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.809 0.337 . . . . 0.0 110.719 -178.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -51.58 -37.51 50.18 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.63 178.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.6 t-20 -132.96 135.65 45.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.764 0.316 . . . . 0.0 110.431 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.7 t -61.36 -42.05 98.07 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.051 -177.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 -59.65 -43.23 94.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.362 0.601 . . . . 0.0 110.152 178.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -56.91 -45.01 82.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.432 0.634 . . . . 0.0 109.998 178.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 46.5 t -59.51 -39.75 84.84 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.588 178.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -59.51 -45.41 91.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.8 0.334 . . . . 0.0 110.704 -177.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 -60.11 -49.35 78.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.054 0.454 . . . . 0.0 110.663 -177.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.718 HG23 HD11 ' A' ' 54' ' ' ILE . 31.7 mm -58.42 -44.86 89.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.974 -178.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 55.8 p -59.31 -43.97 92.61 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.708 -177.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.61 -44.03 94.08 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.63 -0.988 . . . . 0.0 110.63 -178.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.497 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.7 mt -58.47 -48.68 79.98 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.234 0.54 . . . . 0.0 110.514 -178.737 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 52.7 t -58.71 -43.13 87.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.156 -178.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 26.9 m120 -58.34 -42.35 86.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.849 0.357 . . . . 0.0 110.664 -178.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.77 -41.16 99.58 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.409 HD22 ' CD2' ' A' ' 63' ' ' HIS . 50.3 mt -63.97 -45.01 91.02 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.794 0.33 . . . . 0.0 111.18 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 36.1 mt -63.03 -44.98 94.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.295 -176.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -70.2 -36.34 74.53 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.284 -178.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 55.6 p -69.95 159.12 34.32 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.701 0.286 . . . . 0.0 110.503 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 49.3 tttm . . . . . 0 C--O 1.22 -0.495 0 CA-C-O 118.052 -0.975 . . . . 0.0 110.598 -179.645 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.327 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -49.89 140.83 30.24 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 121.32 1.347 . . . . 0.0 111.959 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -118.53 147.58 43.52 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.443 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -81.68 152.92 70.18 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.515 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -87.78 65.4 3.72 Favored 'Trans proline' 0 N--CA 1.49 1.294 0 C-N-CA 121.684 1.59 . . . . 0.0 112.138 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 78.6 mt -57.57 -41.1 80.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.648 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 24.4 tp -124.55 131.32 53.48 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.519 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -82.13 99.95 9.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.473 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -70.79 -39.17 73.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.05 -179.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -88.98 144.17 26.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.874 0.369 . . . . 0.0 110.952 -178.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 78.7 mtp85 -87.63 149.29 24.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.158 178.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -85.87 149.18 50.17 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 119.217 -0.42 . . . . 0.0 110.326 -179.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -63.84 -179.3 0.71 Allowed 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 121.216 1.277 . . . . 0.0 111.715 177.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -60.26 149.83 74.46 Favored Pre-proline 0 C--N 1.33 -0.241 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 177.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 26.7 Cg_exo -57.86 128.79 30.38 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 C-N-CA 120.829 1.019 . . . . 0.0 112.595 -172.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 74.91 -5.24 33.14 Favored Glycine 0 CA--C 1.533 1.173 0 CA-C-N 115.44 -0.8 . . . . 0.0 113.901 173.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -136.39 117.83 14.75 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 118.42 1.11 . . . . 0.0 111.509 -178.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 8.8 ttt -93.34 143.33 26.52 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-O 118.916 -0.564 . . . . 0.0 109.594 172.155 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -49.55 134.83 33.37 Favored 'Trans proline' 0 N--CA 1.497 1.727 0 C-N-CA 121.304 1.336 . . . . 0.0 111.505 172.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 49.8 t-20 -102.0 103.1 13.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.886 0.374 . . . . 0.0 111.569 -174.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1338 ' ' LEU . . . . . 0.42 HD12 ' CB ' ' A' ' 43' ' ' TRP . 21.9 mt -94.0 151.24 39.58 Favored Pre-proline 0 C--N 1.33 -0.272 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 172.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -78.99 139.66 15.41 Favored 'Trans proline' 0 N--CA 1.491 1.364 0 C-N-CA 120.915 1.076 . . . . 0.0 111.201 175.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 5.4 mmmm -97.28 125.93 43.73 Favored Pre-proline 0 CA--C 1.536 0.432 0 CA-C-O 118.456 -0.783 . . . . 0.0 109.966 178.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -78.18 168.47 21.76 Favored 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 121.257 1.305 . . . . 0.0 111.937 175.387 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -65.71 154.57 73.25 Favored 'Trans proline' 0 N--CA 1.495 1.562 0 C-N-CA 121.259 1.306 . . . . 0.0 111.305 175.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.3 tp -50.01 -29.62 9.01 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -176.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 65.3 t80 -54.96 -36.83 65.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.818 0.342 . . . . 0.0 111.349 -176.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1345 ' ' TRP . . . . . 0.708 ' CH2' HD13 ' A' ' 102' ' ' ILE . 23.6 t90 -61.53 -48.15 82.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.423 -176.402 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -61.89 -49.15 77.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.121 0.486 . . . . 0.0 110.366 -178.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -58.82 -44.96 90.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.871 -176.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -59.04 -46.84 87.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.623 -176.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.38 -47.19 86.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.052 0.453 . . . . 0.0 110.652 -177.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -58.87 -43.85 90.97 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.013 -176.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 74.6 mttt -64.85 -46.41 81.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.294 -177.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -54.96 -45.85 74.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.252 -178.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -65.0 -36.97 86.11 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.062 179.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -70.67 141.02 51.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.77 0.319 . . . . 0.0 110.447 179.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 83.4 mt . . . . . 0 C--O 1.22 -0.46 0 CA-C-O 117.962 -1.018 . . . . 0.0 110.53 -179.778 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.3 0 N-CA-C 109.591 -1.404 . . . . 0.0 109.591 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -51.47 130.57 33.58 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 CA-C-N 118.901 1.351 . . . . 0.0 112.042 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -59.49 -41.22 89.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.713 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 86.4 mtp -57.45 -39.4 76.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.905 -179.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -77.75 123.42 26.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.845 0.355 . . . . 0.0 110.617 -179.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -75.59 152.11 37.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.529 179.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 29.7 tp -56.9 -40.67 76.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.674 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.1 mmm -137.41 129.06 28.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.326 179.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -178.61 134.11 0.14 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.513 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -91.17 113.45 25.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.539 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -62.88 -35.27 79.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.331 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.1 t -56.6 -40.69 75.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.904 0.383 . . . . 0.0 110.662 -178.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.6 mm -59.93 -45.31 95.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.199 -178.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.9 m -59.14 -44.62 92.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.467 -178.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -59.43 -46.15 89.54 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.593 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 88.4 mtp -58.17 -43.72 87.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.053 0.454 . . . . 0.0 110.423 -178.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -59.99 -48.65 80.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.268 -178.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.629 ' HA ' HD12 ' A' ' 14' ' ' ILE . 9.8 tp -60.72 -32.89 72.13 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.729 -0.388 . . . . 0.0 111.175 -179.094 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.22 -49.86 74.08 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.726 0.298 . . . . 0.0 110.632 179.003 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.8 -42.13 88.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.057 0.456 . . . . 0.0 110.456 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.715 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 97.7 mt -54.28 -52.88 34.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.627 178.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -53.26 -23.7 9.58 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -57.93 -34.65 70.11 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 120.611 0.244 . . . . 0.0 111.575 -178.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 48.0 mm -107.77 -42.83 6.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.973 0.416 . . . . 0.0 110.208 -177.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -117.16 77.43 9.39 Favored Pre-proline 0 CA--C 1.535 0.372 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.808 -179.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -55.72 -21.19 31.13 Favored 'Trans proline' 0 N--CA 1.498 1.752 0 C-N-CA 121.524 1.482 . . . . 0.0 113.447 -174.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.7 p90 -87.47 -2.15 58.42 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -174.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.33 127.21 31.34 Favored 'General case' 0 N--CA 1.461 0.095 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 177.133 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -97.54 -40.35 8.69 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.653 -175.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -154.79 157.44 37.95 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.3 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 35.4 mt -93.87 136.75 24.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.824 177.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.5 t -87.41 -44.98 16.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.68 177.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.504 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -158.35 157.94 33.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.845 178.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.2 p -142.87 132.9 24.32 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.999 0.428 . . . . 0.0 111.266 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.6 t -109.98 125.74 53.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.663 176.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.1 m -54.84 -38.93 68.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.169 -172.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -148.89 126.45 11.67 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.247 0.546 . . . . 0.0 111.76 -178.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.498 HG22 ' CD1' ' A' ' 107' ' ' PHE . 97.3 t -145.2 140.19 22.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.333 -178.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.91 149.84 51.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.722 0.296 . . . . 0.0 111.268 -177.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.481 ' HD2' HG21 ' A' ' 46' ' ' THR . 25.6 t80 -100.77 130.33 46.78 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.549 -176.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -126.23 143.96 50.95 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.73 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 96.2 m -123.51 146.73 47.86 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -108.64 132.0 54.33 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.962 0.41 . . . . 0.0 110.333 176.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -105.18 114.22 28.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.82 176.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 84.8 p -70.8 -29.69 65.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.0 -0.546 . . . . 0.0 112.338 -175.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.3 t -58.9 -39.23 80.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.805 0.336 . . . . 0.0 110.943 -177.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -100.58 -17.88 16.86 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.9 t30 69.82 48.05 0.59 Allowed 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.596 0.712 . . . . 0.0 109.46 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 78.6 tt0 -153.57 151.62 29.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.774 -178.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 82.6 m95 -88.37 142.78 27.45 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.393 178.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -124.99 130.39 52.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.86 176.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.5 pttp -75.02 141.26 43.94 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 177.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.481 HG21 ' HD2' ' A' ' 33' ' ' PHE . 67.5 p -92.3 175.55 6.8 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.699 -0.401 . . . . 0.0 110.067 -179.019 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -85.31 13.28 6.72 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.7 t -107.95 106.36 20.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-O 121.014 0.435 . . . . 0.0 110.351 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -132.1 112.2 12.12 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 174.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.64 176.53 38.95 Favored Glycine 0 CA--C 1.52 0.389 0 C-N-CA 120.184 -1.007 . . . . 0.0 112.222 -168.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.494 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.97 135.37 36.91 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 175.198 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.445 ' HB3' HG21 ' A' ' 31' ' ' VAL . 7.0 t80 -98.94 127.75 44.94 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.107 -176.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.494 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 9.2 m-85 -131.75 141.97 49.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.331 177.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.64 HD11 HG23 ' A' ' 116' ' ' ILE . 63.9 mt -101.59 129.24 53.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 173.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.715 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 10.3 m-30 -108.49 137.38 46.54 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.791 0.329 . . . . 0.0 111.213 -175.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 57.6 t60 -121.35 143.3 49.27 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.289 176.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 29.1 ttp180 -142.01 153.84 44.56 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.303 177.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -86.85 28.17 0.92 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.152 -179.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -155.78 152.87 29.0 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -63.95 133.55 95.62 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-O 118.5 -0.762 . . . . 0.0 110.243 -176.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -68.19 140.92 57.98 Favored 'Cis proline' 0 N--CA 1.499 1.794 0 CA-C-N 121.703 1.644 . . . . 0.0 111.45 -0.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -66.74 -41.32 88.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.135 -176.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.414 ' HB3' HD12 ' A' ' 80' ' ' ILE . 74.0 m80 -142.44 143.42 32.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.7 0.762 . . . . 0.0 111.249 -175.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.6 t -150.31 151.95 33.72 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.847 -179.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 48.2 mt -112.35 138.4 41.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 -177.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -131.79 142.09 49.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.03 -177.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.8 mt -123.06 131.87 72.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.252 0.549 . . . . 0.0 109.783 172.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -97.8 99.58 10.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.426 179.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -72.03 107.28 4.66 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 123.618 0.573 . . . . 0.0 110.992 -175.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -73.4 -41.96 62.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.278 -171.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 74.7 mt -70.3 -45.13 66.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.671 -175.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 39.9 m-20 -95.09 -3.23 48.48 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -175.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.8 p 51.07 42.31 28.43 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.523 0.678 . . . . 0.0 111.065 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 38.5 m -125.2 149.08 48.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.164 -179.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.4 p -98.2 137.73 36.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.999 -178.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -132.97 122.19 23.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.118 175.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 p -125.62 150.38 30.89 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.205 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.049 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -148.71 132.8 8.68 Favored Pre-proline 0 CA--C 1.538 0.503 0 CA-C-O 118.879 -0.581 . . . . 0.0 110.401 174.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -75.46 150.95 36.93 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 121.578 1.518 . . . . 0.0 112.29 179.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.414 HD12 ' HB3' ' A' ' 63' ' ' HIS . 69.7 mt -90.51 136.31 24.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 C-N-CA 120.704 -0.398 . . . . 0.0 110.2 177.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.6 p -132.14 158.49 41.53 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.839 177.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -95.7 35.46 4.3 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.058 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.3 p -109.0 -23.33 11.74 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 173.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.89 147.68 51.34 Favored 'General case' 0 C--O 1.231 0.082 0 CA-C-O 120.887 0.375 . . . . 0.0 111.207 -176.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 59.3 tt0 -118.56 135.91 54.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.799 175.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 51.6 mt -114.25 161.05 18.34 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.715 -176.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -150.06 142.68 24.53 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 177.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.0 t -98.5 109.15 21.95 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.444 -0.502 . . . . 0.0 110.588 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 -106.9 103.75 48.74 Favored Pre-proline 0 C--N 1.328 -0.344 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 171.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -70.26 143.15 47.59 Favored 'Trans proline' 0 N--CA 1.497 1.734 0 CA-C-N 120.496 1.213 . . . . 0.0 112.003 -171.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -91.17 14.73 49.52 Favored 'Cis proline' 0 N--CA 1.499 1.798 0 CA-C-N 120.964 1.38 . . . . 0.0 113.561 -3.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -97.0 172.64 7.73 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.458 0.171 . . . . 0.0 110.58 -177.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 52.5 tp -114.5 135.07 54.52 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 173.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.419 HD21 ' HZ2' ' B' 1345 ' ' TRP . 9.4 tp -127.17 139.56 52.87 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 -174.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 19.6 p90 -146.61 160.9 41.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.91 0.386 . . . . 0.0 110.614 175.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 30.5 mtm105 -101.9 146.15 28.24 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.471 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 36.3 t30 -127.26 164.64 21.27 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.78 0.8 . . . . 0.0 111.732 -176.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -48.0 147.51 2.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.203 -176.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 63.23 30.95 15.78 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.152 179.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 46.5 t 66.62 35.2 5.45 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.896 0.379 . . . . 0.0 111.583 166.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -100.74 152.63 20.25 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 73.9 mt -110.19 129.18 65.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 -179.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -138.3 150.25 46.45 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.789 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -144.29 169.34 26.38 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 111.359 -0.696 . . . . 0.0 111.359 -176.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -125.34 140.96 52.36 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.948 0.404 . . . . 0.0 110.809 -178.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 17.2 t90 -108.38 127.74 54.15 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.81 175.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.498 ' CD1' HG22 ' A' ' 31' ' ' VAL . 79.4 m-85 -115.26 142.02 47.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.762 0.315 . . . . 0.0 110.356 178.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -50.93 -38.25 49.05 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.78 178.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.7 t-20 -133.39 137.27 45.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.309 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.0 m -59.81 -41.74 91.92 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.957 -177.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -58.17 -42.24 85.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.285 0.564 . . . . 0.0 110.18 178.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -57.26 -44.78 84.22 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.508 0.67 . . . . 0.0 109.909 178.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 43.5 t -59.22 -37.01 76.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.797 176.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -63.11 -51.73 65.39 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 121.208 -0.197 . . . . 0.0 111.182 -174.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 29.6 ptt180 -64.76 -42.41 95.14 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.35 -0.54 . . . . 0.0 111.339 -175.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.64 HG23 HD11 ' A' ' 54' ' ' ILE . 26.5 mm -60.04 -48.13 89.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.175 0 C-N-CA 120.507 -0.477 . . . . 0.0 109.883 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 66.5 p -59.32 -43.2 92.71 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.832 0.349 . . . . 0.0 110.644 -177.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.77 -43.73 94.47 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.631 -0.987 . . . . 0.0 110.631 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.504 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.1 mt -57.93 -47.78 81.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.214 0.531 . . . . 0.0 110.497 -178.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 49.3 t -59.01 -44.14 90.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.035 -179.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -57.36 -42.74 82.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.689 -178.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.12 -46.02 95.37 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.006 -0.838 . . . . 0.0 111.006 -178.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 56.9 mt -57.83 -43.07 85.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.016 0.436 . . . . 0.0 110.507 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 39.3 mt -60.25 -40.2 89.46 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.802 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 31.9 pttt -94.63 11.15 32.13 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 64.7 m -117.22 147.11 42.79 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.875 0.369 . . . . 0.0 110.401 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt . . . . . 0 C--O 1.22 -0.483 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.494 -179.958 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.294 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -49.86 148.72 12.16 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 121.342 1.361 . . . . 0.0 111.955 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -95.16 125.64 39.94 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.512 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -65.92 154.24 89.72 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.568 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -87.29 33.04 0.42 Allowed 'Trans proline' 0 N--CA 1.49 1.316 0 C-N-CA 121.682 1.588 . . . . 0.0 112.37 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 29.8 tp -56.75 -39.97 74.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.791 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.0 mt -84.26 142.65 30.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.394 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -90.1 116.15 27.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.608 -179.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -62.54 -40.61 97.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.725 179.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -144.01 167.11 23.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.695 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 37.3 ptt-85 -98.44 142.83 29.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.7 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -65.24 156.42 81.39 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.688 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -68.29 146.44 69.31 Favored 'Trans proline' 0 N--CA 1.495 1.61 0 C-N-CA 121.244 1.296 . . . . 0.0 112.012 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -125.95 99.97 31.15 Favored Pre-proline 0 CA--C 1.533 0.306 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.998 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -57.9 128.96 31.01 Favored 'Trans proline' 0 N--CA 1.497 1.69 0 C-N-CA 121.103 1.202 . . . . 0.0 111.506 -178.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 102.02 -5.13 52.94 Favored Glycine 0 CA--C 1.537 1.414 0 CA-C-N 115.779 -0.646 . . . . 0.0 113.222 -178.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -84.29 145.69 28.15 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 118.165 0.982 . . . . 0.0 110.48 177.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 28.9 ttp -66.39 143.45 98.25 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 119.067 -0.492 . . . . 0.0 110.045 -179.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -58.05 156.91 27.0 Favored 'Trans proline' 0 N--CA 1.496 1.656 0 C-N-CA 121.242 1.294 . . . . 0.0 111.825 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 10.9 p-10 -103.99 111.02 23.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.902 -179.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 8.3 mt -79.76 130.23 68.14 Favored Pre-proline 0 CA--C 1.533 0.307 0 CA-C-O 118.169 -0.92 . . . . 0.0 109.412 177.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -79.14 139.55 15.08 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 CA-C-N 120.615 1.255 . . . . 0.0 111.155 174.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 41.6 mtmt -97.38 126.02 43.21 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-O 118.453 -0.784 . . . . 0.0 110.32 179.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -64.55 167.8 14.38 Favored 'Trans proline' 0 N--CA 1.498 1.757 0 CA-C-N 120.564 1.237 . . . . 0.0 111.619 175.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -56.55 157.11 19.74 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 121.402 1.401 . . . . 0.0 111.445 178.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 12.3 tp -50.01 -29.96 9.68 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -176.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 58.2 t80 -54.95 -37.42 66.43 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.921 0.391 . . . . 0.0 111.161 -177.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1345 ' ' TRP . . . . . 0.419 ' HZ2' HD21 ' A' ' 94' ' ' LEU . 43.6 t90 -60.2 -48.05 83.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.225 -177.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -61.88 -47.94 82.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.026 0.441 . . . . 0.0 110.626 -177.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -59.63 -45.09 93.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.86 -177.099 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 42.7 tp10 -59.23 -46.17 89.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.695 -176.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.26 -48.34 82.17 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.039 0.447 . . . . 0.0 110.751 -177.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -59.29 -43.02 92.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.15 -176.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 83.5 tttt -64.22 -47.14 80.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.143 -177.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 57.2 tp60 -54.99 -47.97 73.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.15 -178.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 42.2 tp10 -64.93 -37.06 86.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.149 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -129.96 112.44 13.51 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.882 0.372 . . . . 0.0 110.622 -179.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 78.4 mt . . . . . 0 C--O 1.221 -0.426 0 CA-C-O 117.962 -1.018 . . . . 0.0 110.607 -179.955 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.257 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -67.57 132.63 27.61 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 121.307 1.338 . . . . 0.0 111.965 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -58.67 -40.78 84.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.746 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 65.0 mtt -91.42 141.85 28.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.656 -179.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -68.12 148.33 51.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.634 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -138.17 173.66 11.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.484 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 30.0 tp -57.09 -41.53 79.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.565 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt -104.66 133.97 48.62 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.311 179.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.563 ' HB1' HG13 ' A' ' 6' ' ' ILE . . . -150.55 168.11 25.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.693 -179.398 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -57.48 161.76 3.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.74 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -59.98 -32.82 71.2 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.48 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.4 m -56.11 -40.46 73.74 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.908 0.385 . . . . 0.0 110.639 -178.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.563 HG13 ' HB1' ' A' ' 2' ' ' ALA . 44.7 mm -59.56 -44.82 94.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.128 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.5 m -58.62 -45.07 90.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.061 0.458 . . . . 0.0 110.439 -178.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -59.26 -45.38 91.36 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.58 -178.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 89.2 mtp -58.27 -42.4 86.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.449 -178.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -60.1 -49.93 75.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.287 -178.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.736 ' HA ' HD12 ' A' ' 14' ' ' ILE . 12.7 tp -60.53 -31.02 70.12 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.323 -179.303 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.76 -50.92 67.17 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.676 0.274 . . . . 0.0 110.733 178.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.36 -40.23 81.7 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.953 0.406 . . . . 0.0 110.674 179.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.736 HD12 ' HA ' ' A' ' 11' ' ' LEU . 97.7 mt -54.24 -52.9 33.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.485 177.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -51.55 -22.38 3.2 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.9 mmtt -58.72 -35.09 72.12 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 122.296 -0.253 . . . . 0.0 111.631 -178.097 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 48.2 mm -108.19 -43.26 6.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.908 0.385 . . . . 0.0 110.116 -177.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.1 t0 -117.36 77.3 9.98 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.129 -176.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -54.84 -22.45 29.86 Favored 'Trans proline' 0 N--CA 1.498 1.747 0 C-N-CA 121.5 1.466 . . . . 0.0 113.33 -176.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.0 p90 -88.65 8.74 27.02 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -175.011 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -88.61 123.81 33.44 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 174.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.475 ' O ' HD21 ' A' ' 11' ' ' LEU . 28.4 mmtp -104.86 -40.06 6.07 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.991 -173.107 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -132.02 145.63 51.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.145 -176.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.434 HG13 HD13 ' A' ' 11' ' ' LEU . 63.0 mt -96.66 128.13 48.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.87 -0.604 . . . . 0.0 109.731 173.117 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.3 t -89.26 -47.11 15.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.047 0.451 . . . . 0.0 109.965 -179.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.478 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.1 t0 -154.22 150.26 27.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.023 177.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.8 p -138.46 131.95 30.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.059 0.456 . . . . 0.0 110.743 179.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.4 t -104.74 126.9 52.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.482 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.2 m -53.91 -38.03 64.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.366 -171.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -151.92 127.82 10.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.225 0.536 . . . . 0.0 111.724 -178.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.424 HG22 ' CD2' ' A' ' 107' ' ' PHE . 94.9 t -145.15 136.99 20.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.542 -177.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -126.36 149.86 48.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.173 -178.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.682 ' CD2' HG21 ' A' ' 46' ' ' THR . 36.3 t80 -96.99 133.09 42.12 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.334 0.588 . . . . 0.0 111.788 -176.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -127.04 137.98 53.15 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.283 177.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.4 m -119.03 143.46 47.08 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 178.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -107.93 130.57 55.02 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.008 0.432 . . . . 0.0 110.246 177.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -101.76 113.74 27.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.063 176.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 86.1 p -70.88 -25.79 62.95 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -177.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.0 m -58.89 -36.4 74.61 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 121.121 -0.232 . . . . 0.0 111.244 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -113.95 -12.04 12.7 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -177.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 58.7 t30 69.74 50.51 0.49 Allowed 'General case' 0 C--O 1.233 0.216 0 CA-C-O 121.704 0.764 . . . . 0.0 109.592 179.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.7 tp10 -148.01 146.93 29.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.908 -178.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.453 ' CB ' HD12 ' B' 1338 ' ' LEU . 83.7 m95 -89.2 141.0 28.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.176 176.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -121.42 126.31 49.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.229 -0.441 . . . . 0.0 109.916 176.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.9 ttpp -73.17 135.14 44.6 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 177.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.682 HG21 ' CD2' ' A' ' 33' ' ' PHE . 67.9 p -92.35 162.1 14.4 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.24 -177.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -75.95 5.68 6.21 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.3 t -97.16 106.42 18.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-O 121.091 0.472 . . . . 0.0 110.29 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -131.73 115.5 16.09 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 176.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.5 38.96 Favored Glycine 0 CA--C 1.52 0.392 0 C-N-CA 120.063 -1.065 . . . . 0.0 112.392 -169.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.5 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -80.94 136.47 36.04 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -102.18 123.8 46.65 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -175.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.5 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 4.5 m-85 -128.53 140.92 51.55 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.644 0.259 . . . . 0.0 110.721 177.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.492 HD11 HG23 ' A' ' 116' ' ' ILE . 74.8 mt -101.63 127.35 55.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 170.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.591 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 11.2 m-30 -108.53 140.62 41.61 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.018 0.437 . . . . 0.0 111.665 -177.35 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -108.82 143.38 38.08 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.934 173.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -140.89 145.51 36.24 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.028 178.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -86.93 28.17 0.93 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.217 -0.447 . . . . 0.0 112.03 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.28 164.15 36.7 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -63.96 128.83 93.44 Favored Pre-proline 0 CA--C 1.539 0.557 0 CA-C-O 118.401 -0.809 . . . . 0.0 110.024 -177.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.61 140.9 69.9 Favored 'Cis proline' 0 N--CA 1.497 1.719 0 CA-C-N 121.909 1.717 . . . . 0.0 111.738 -1.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -63.97 -41.37 97.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.986 -177.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.442 ' HB3' HD12 ' A' ' 80' ' ' ILE . 73.9 m80 -143.15 137.94 29.43 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.315 0.579 . . . . 0.0 110.911 -177.233 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.0 t -150.04 151.63 33.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.421 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 56.7 mt -115.08 139.81 39.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.961 -177.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -131.79 142.09 49.65 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.082 -178.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.1 mt -119.84 126.69 75.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.207 0.527 . . . . 0.0 109.771 171.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -94.66 99.56 11.65 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.648 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.5 t-20 -73.28 105.96 4.91 Favored 'General case' 0 C--N 1.332 -0.16 0 O-C-N 123.687 0.617 . . . . 0.0 110.934 -175.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 25.9 mmt85 -74.36 -40.48 62.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.447 -170.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 45.0 mt -74.07 -45.16 51.05 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.77 0.319 . . . . 0.0 111.411 -175.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 29.8 t-20 -95.04 -3.2 48.7 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -175.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.5 p 50.95 43.22 28.83 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.496 0.665 . . . . 0.0 111.147 178.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 37.2 m -122.97 142.94 50.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.143 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.2 p -91.83 127.97 37.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.29 -178.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -117.46 122.15 42.96 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 175.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.6 p -125.56 146.96 30.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-O 120.705 0.288 . . . . 0.0 111.08 -178.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -149.83 126.48 5.3 Favored Pre-proline 0 CA--C 1.539 0.546 0 CA-C-O 118.557 -0.735 . . . . 0.0 110.345 175.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -75.36 150.86 37.22 Favored 'Trans proline' 0 N--CA 1.498 1.765 0 C-N-CA 121.388 1.392 . . . . 0.0 112.105 177.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.442 HD12 ' HB3' ' A' ' 63' ' ' HIS . 63.1 mt -90.67 135.95 25.28 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.121 0 CA-C-O 120.937 0.399 . . . . 0.0 110.376 179.091 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.9 p -132.12 154.71 49.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.667 177.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -93.79 35.82 4.0 Favored Glycine 0 CA--C 1.525 0.68 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.048 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 46.7 p -111.0 -21.08 12.18 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 111.995 0.368 . . . . 0.0 111.995 174.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.6 mt -68.43 147.19 52.42 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-O 120.909 0.385 . . . . 0.0 111.367 -175.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.9 tt0 -114.31 135.82 53.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.768 176.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 60.4 mt -115.6 157.58 23.93 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.959 0.409 . . . . 0.0 110.882 -176.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -149.22 142.39 25.01 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 178.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.1 t -99.03 109.14 21.93 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.613 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -106.8 103.73 48.36 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 172.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -70.55 142.99 45.8 Favored 'Trans proline' 0 N--CA 1.497 1.72 0 CA-C-N 120.546 1.231 . . . . 0.0 112.138 -170.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -90.62 14.27 50.96 Favored 'Cis proline' 0 N--CA 1.5 1.901 0 CA-C-N 121.049 1.41 . . . . 0.0 113.534 -4.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -94.89 170.42 9.44 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 122.378 0.271 . . . . 0.0 110.758 -177.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 54.1 tp -116.1 133.2 56.28 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 173.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.8 tp -124.67 139.98 53.36 Favored 'General case' 0 C--N 1.334 -0.101 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 -173.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -144.5 153.09 41.5 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.972 0.415 . . . . 0.0 110.564 175.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.6 mtm180 -103.89 144.35 31.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.739 -177.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -127.57 163.05 25.02 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.893 0.854 . . . . 0.0 111.761 -176.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -47.84 149.24 1.35 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.14 -177.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 87.5 mtt-85 63.5 30.87 15.15 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.155 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 34.9 m 66.27 35.16 6.07 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.913 0.387 . . . . 0.0 111.628 165.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 40.3 mtp180 -99.87 147.32 25.65 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 82.9 mt -113.33 126.92 70.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -178.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -136.12 148.36 48.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.429 -178.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -144.73 169.3 26.62 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 120.771 -0.728 . . . . 0.0 111.651 -178.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -126.0 141.85 51.78 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.292 -0.454 . . . . 0.0 110.565 179.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 77.5 t90 -106.63 124.02 48.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.511 174.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.424 ' CD2' HG22 ' A' ' 31' ' ' VAL . 59.5 m-85 -109.65 140.19 43.78 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 123.312 0.383 . . . . 0.0 110.523 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -50.33 -37.13 35.15 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.845 178.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 39.1 t-20 -133.72 135.49 44.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.345 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.2 m -61.63 -42.77 99.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.056 -177.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -59.43 -43.64 93.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.373 0.606 . . . . 0.0 110.084 179.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -56.56 -43.7 80.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.133 178.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 51.4 t -59.31 -40.99 87.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.353 177.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -58.88 -44.57 91.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.8 0.333 . . . . 0.0 110.627 -177.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -59.99 -49.74 76.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.944 0.402 . . . . 0.0 110.649 -177.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.492 HG23 HD11 ' A' ' 54' ' ' ILE . 29.8 mm -58.46 -45.31 90.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.099 0.476 . . . . 0.0 110.067 -178.344 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 61.1 p -59.41 -43.03 93.1 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.73 -177.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.73 -43.99 94.3 Favored Glycine 0 CA--C 1.523 0.545 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 -178.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.478 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.8 mt -58.4 -48.21 81.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.074 0.464 . . . . 0.0 110.459 -178.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.442 ' HA ' HD12 ' A' ' 123' ' ' LEU . 55.4 t -59.0 -42.57 86.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.167 -179.225 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.467 ' HA ' HD12 ' A' ' 124' ' ' LEU . 26.6 m120 -57.38 -42.07 81.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.896 0.379 . . . . 0.0 110.605 -179.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -59.65 -44.63 96.72 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.442 HD12 ' HA ' ' A' ' 120' ' ' VAL . 58.0 mt -57.68 -42.99 84.74 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.98 0.419 . . . . 0.0 110.429 179.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.467 HD12 ' HA ' ' A' ' 121' ' ' ASN . 17.7 mt -58.18 -41.88 84.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.548 179.121 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 38.0 pttt -96.47 11.14 36.07 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 29.7 t -114.4 144.45 43.28 Favored 'General case' 0 N--CA 1.462 0.14 0 O-C-N 122.141 -0.349 . . . . 0.0 110.453 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 98.1 mttt . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 118.043 -0.979 . . . . 0.0 110.566 179.982 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.343 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -65.16 142.69 74.96 Favored 'Trans proline' 0 N--CA 1.497 1.687 0 CA-C-N 119.296 1.548 . . . . 0.0 111.936 -176.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -120.35 155.4 33.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.492 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -62.41 154.1 73.58 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.572 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -72.25 132.41 19.37 Favored 'Trans proline' 0 N--CA 1.495 1.589 0 C-N-CA 121.298 1.332 . . . . 0.0 112.117 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 78.6 mt -63.79 -38.65 91.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.937 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 27.2 tp -78.6 139.0 38.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.86 0.362 . . . . 0.0 110.605 -179.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 51.7 tp60 -87.33 129.79 34.87 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.502 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -57.71 -38.67 75.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.048 -179.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -56.56 145.51 28.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.876 0.37 . . . . 0.0 110.75 -179.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 34.4 ttm180 -72.38 144.66 48.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.705 -179.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -57.3 164.29 2.74 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.453 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -48.14 142.01 16.87 Favored 'Trans proline' 0 N--CA 1.495 1.58 0 C-N-CA 121.425 1.417 . . . . 0.0 112.259 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 29.7 p90 -138.99 163.86 43.37 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.51 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -57.85 129.02 31.31 Favored 'Trans proline' 0 N--CA 1.495 1.596 0 C-N-CA 121.19 1.26 . . . . 0.0 111.664 -178.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 100.74 -5.14 56.59 Favored Glycine 0 CA--C 1.535 1.318 0 CA-C-N 115.948 -0.569 . . . . 0.0 113.424 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -64.61 140.34 58.86 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 118.206 1.003 . . . . 0.0 110.42 177.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 6.8 ttt -61.29 139.24 94.68 Favored Pre-proline 0 CA--C 1.534 0.364 0 CA-C-O 118.898 -0.572 . . . . 0.0 109.782 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.11 148.9 40.34 Favored 'Trans proline' 0 N--CA 1.495 1.581 0 C-N-CA 121.243 1.296 . . . . 0.0 111.926 178.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 52.9 t-20 -94.88 104.82 16.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.626 -179.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1338 ' ' LEU . . . . . 0.453 HD12 ' CB ' ' A' ' 43' ' ' TRP . 18.9 mt -70.81 134.67 85.84 Favored Pre-proline 0 C--O 1.234 0.279 0 CA-C-O 118.461 -0.781 . . . . 0.0 109.488 179.414 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.21 139.65 15.04 Favored 'Trans proline' 0 N--CA 1.493 1.452 0 CA-C-N 120.435 1.191 . . . . 0.0 111.083 174.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 19.8 mtmm -97.31 125.94 43.64 Favored Pre-proline 0 CA--C 1.535 0.401 0 CA-C-O 118.514 -0.755 . . . . 0.0 110.188 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -63.25 161.15 31.69 Favored 'Trans proline' 0 N--CA 1.498 1.759 0 CA-C-N 120.563 1.237 . . . . 0.0 111.553 176.045 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -49.19 157.04 2.07 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 121.38 1.386 . . . . 0.0 111.812 178.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1343 ' ' LEU . . . . . 0.531 ' H ' HD12 ' B' 1343 ' ' LEU . 6.2 mp -49.99 -25.58 3.47 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -176.492 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 68.8 t80 -55.95 -38.46 70.39 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.809 0.337 . . . . 0.0 111.084 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 50.5 t90 -60.88 -48.08 83.42 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.509 -176.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -63.61 -49.27 73.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.067 0.46 . . . . 0.0 110.785 -177.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -59.34 -43.86 92.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.926 -176.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -59.19 -48.32 82.04 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.638 -176.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.17 -49.12 78.87 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.733 -177.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -59.6 -41.48 90.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.226 -176.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 26.4 tptp -64.81 -48.33 74.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.126 -177.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -55.03 -47.42 74.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.227 -178.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -64.95 -36.83 85.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.215 178.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -63.35 148.15 49.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.801 0.334 . . . . 0.0 110.608 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1355 ' ' LEU . . . . . 0.479 ' C ' HD23 ' B' 1355 ' ' LEU . 6.5 tt . . . . . 0 C--O 1.22 -0.495 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.586 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.302 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -67.88 139.53 47.81 Favored 'Trans proline' 0 N--CA 1.496 1.636 0 CA-C-N 118.906 1.353 . . . . 0.0 111.96 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -57.31 -41.63 80.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.613 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 72.1 mtm -104.82 157.83 16.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.565 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -141.19 152.75 44.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.581 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -67.9 151.23 47.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.552 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 79.0 mt -56.78 -40.53 76.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.696 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.5 mtp -101.31 139.75 36.55 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.444 179.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.534 ' HB1' HG13 ' A' ' 6' ' ' ILE . . . -140.55 155.77 46.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.505 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.3 p30 -78.0 -177.98 5.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.66 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -63.38 -31.44 72.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.854 -179.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.1 m -57.36 -44.58 84.5 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.911 0.386 . . . . 0.0 110.589 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.534 HG13 ' HB1' ' A' ' 2' ' ' ALA . 48.2 mm -59.81 -44.7 94.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.216 -178.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.0 m -59.58 -44.05 93.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.571 -177.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -59.92 -45.2 93.33 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.563 -178.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 87.8 mtp -58.26 -44.21 88.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.093 0.473 . . . . 0.0 110.458 -178.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -60.75 -49.18 78.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.296 -178.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.66 ' HA ' HD12 ' A' ' 14' ' ' ILE . 10.4 tp -59.75 -33.02 71.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.058 -178.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.34 -50.58 69.44 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.649 0.262 . . . . 0.0 110.851 179.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.96 -41.67 83.38 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.944 0.402 . . . . 0.0 110.404 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.677 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 93.9 mt -54.13 -52.98 32.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.724 178.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -51.93 -24.76 6.85 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -178.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 65.8 mmtt -59.24 -33.73 71.37 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -177.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.6 mm -109.77 -43.67 5.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.0 0.429 . . . . 0.0 110.071 -176.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -117.61 77.15 10.7 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.968 -178.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -55.2 -20.49 24.78 Favored 'Trans proline' 0 N--CA 1.497 1.731 0 C-N-CA 121.47 1.447 . . . . 0.0 113.531 -175.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.3 p90 -90.61 11.62 21.44 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -174.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -88.15 131.21 34.8 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 174.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.572 ' O ' HD21 ' A' ' 11' ' ' LEU . 99.1 mttt -108.31 -38.69 5.66 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.745 0.307 . . . . 0.0 111.145 -175.17 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -135.86 147.65 48.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.007 0.432 . . . . 0.0 111.183 -175.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.411 HD11 HD12 ' A' ' 14' ' ' ILE . 21.8 mt -99.39 134.28 39.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 171.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.6 t -92.83 -47.13 13.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.242 -0.435 . . . . 0.0 109.877 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.504 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.1 t0 -152.23 155.06 36.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.014 178.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.1 p -142.7 131.95 23.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.171 0.51 . . . . 0.0 110.895 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.6 t -107.27 126.58 52.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.695 177.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.7 t -54.38 -38.67 66.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.154 -172.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 -150.7 127.21 10.78 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.294 0.569 . . . . 0.0 111.689 -179.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.439 HG21 ' HB3' ' A' ' 52' ' ' PHE . 92.8 t -144.84 138.55 22.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.336 -178.094 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.59 149.81 50.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.303 -177.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -99.68 131.2 45.82 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.259 0.552 . . . . 0.0 111.833 -176.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -123.85 141.75 51.75 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.466 178.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 72.5 m -120.99 147.01 46.08 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -107.79 131.9 53.97 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 120.951 0.405 . . . . 0.0 110.416 175.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.6 t-20 -104.31 115.65 30.76 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.977 178.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 27.1 t -67.65 -33.12 74.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.9 -177.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.1 m -60.56 -39.79 89.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.752 0.31 . . . . 0.0 110.887 -177.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -93.13 -21.52 19.63 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 19.2 t30 69.13 42.69 1.2 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-O 121.288 0.566 . . . . 0.0 109.809 -177.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.0 mt-10 -151.34 164.17 37.29 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.156 -177.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.428 ' CB ' HD12 ' B' 1338 ' ' LEU . 83.9 m95 -94.12 141.66 28.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.352 177.537 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.9 tp10 -124.97 127.53 47.17 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 177.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.7 ttpp -73.64 139.15 45.25 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 177.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 52.4 p -92.23 172.23 8.55 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.071 -178.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 76.9 m-20 -84.08 12.6 6.13 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 178.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.7 t -104.05 106.43 20.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-O 121.068 0.461 . . . . 0.0 110.346 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -132.22 114.43 14.45 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 176.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.59 176.51 38.91 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.022 -1.085 . . . . 0.0 112.3 -169.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.484 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -81.31 135.81 35.73 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 175.415 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.439 ' HB3' HG21 ' A' ' 31' ' ' VAL . 6.2 t80 -99.42 127.34 45.46 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.883 -0.327 . . . . 0.0 110.126 -176.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.484 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 7.4 m-85 -131.67 142.46 49.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.723 0.297 . . . . 0.0 110.339 177.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.673 HD11 HG23 ' A' ' 116' ' ' ILE . 68.6 mt -101.61 127.95 54.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 171.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.677 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.3 m-30 -108.53 135.55 49.61 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.855 0.36 . . . . 0.0 111.302 -175.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 68.8 t60 -109.71 143.28 39.72 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.104 174.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 60.5 ttt180 -141.92 146.75 36.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.233 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -86.88 28.11 0.93 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.112 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.7 166.16 33.53 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -63.99 127.64 92.03 Favored Pre-proline 0 CA--C 1.539 0.537 0 CA-C-O 118.445 -0.788 . . . . 0.0 110.066 -177.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -75.98 140.94 68.94 Favored 'Cis proline' 0 N--CA 1.497 1.702 0 CA-C-N 121.89 1.711 . . . . 0.0 111.765 -1.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -62.45 -42.26 99.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.945 -178.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.4 ' HB3' HD12 ' A' ' 80' ' ' ILE . 73.3 m80 -142.84 138.58 30.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.436 0.636 . . . . 0.0 110.891 -177.131 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.8 t -150.19 151.73 33.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.311 -178.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 47.7 mt -110.31 139.81 32.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -131.78 142.03 49.64 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.761 -176.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 59.7 mt -124.62 128.99 73.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.249 0.547 . . . . 0.0 110.06 173.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -96.26 99.54 11.24 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 114.91 -1.041 . . . . 0.0 109.53 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.2 t-20 -74.7 106.29 6.19 Favored 'General case' 0 C--N 1.331 -0.209 0 O-C-N 123.647 0.592 . . . . 0.0 110.933 -175.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 71.2 mtm180 -73.16 -43.91 60.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.588 -170.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 29.8 mt -72.56 -45.09 60.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.634 -174.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 37.2 t-20 -95.13 -3.11 48.57 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -174.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 73.0 p 50.73 42.9 28.0 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.478 0.656 . . . . 0.0 111.186 177.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.0 m -125.43 133.87 52.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.275 -179.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 80.4 p -80.16 130.45 35.24 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.301 -178.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -118.46 122.22 42.19 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 174.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 34.6 t -125.48 145.62 32.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-O 120.725 0.298 . . . . 0.0 110.674 -177.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -148.26 126.41 5.93 Favored Pre-proline 0 CA--C 1.538 0.492 0 CA-C-O 118.64 -0.695 . . . . 0.0 110.496 174.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -75.42 150.9 37.02 Favored 'Trans proline' 0 N--CA 1.5 1.875 0 C-N-CA 121.462 1.442 . . . . 0.0 112.184 177.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.4 HD12 ' HB3' ' A' ' 63' ' ' HIS . 66.5 mt -92.15 133.09 34.69 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.31 178.257 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.6 p -132.21 159.54 38.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.732 177.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -94.54 36.69 3.67 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.96 -178.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 51.7 p -111.07 -22.49 11.44 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 174.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.84 145.04 54.07 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-O 120.878 0.37 . . . . 0.0 111.251 -176.062 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 57.5 tt0 -116.93 135.78 53.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.729 175.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 63.2 mt -113.28 159.19 19.62 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.702 -176.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -150.02 143.94 25.49 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 178.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 29.3 t -99.59 109.15 21.68 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.462 -0.495 . . . . 0.0 110.326 178.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.404 ' HG3' HD22 ' A' ' 94' ' ' LEU . 19.3 mm-40 -106.83 103.75 48.55 Favored Pre-proline 0 C--N 1.329 -0.317 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 172.638 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -67.38 142.37 59.68 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 CA-C-N 120.491 1.211 . . . . 0.0 111.787 -172.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -90.76 12.73 55.38 Favored 'Cis proline' 0 N--CA 1.5 1.899 0 CA-C-N 121.146 1.445 . . . . 0.0 113.493 -4.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -94.9 170.17 9.62 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 122.304 0.242 . . . . 0.0 110.618 -176.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 58.0 tp -111.99 134.91 53.25 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 171.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.441 HD21 ' HZ2' ' B' 1345 ' ' TRP . 10.6 tp -126.88 139.65 52.92 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.5 0.191 . . . . 0.0 110.606 -173.395 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 50.9 p90 -145.5 156.81 43.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.798 0.332 . . . . 0.0 110.534 175.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.8 mtm105 -102.07 146.89 27.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.66 -178.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -126.47 163.81 22.52 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.591 0.71 . . . . 0.0 111.374 -177.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -47.16 144.86 2.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.192 -177.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 31.9 ttt85 65.27 30.92 11.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.416 -0.811 . . . . 0.0 112.021 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.5 p 65.59 35.24 7.22 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.871 0.367 . . . . 0.0 111.719 166.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 91.7 mtt-85 -98.0 152.74 18.95 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.363 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 78.3 mt -114.58 127.58 72.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -177.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -137.56 150.32 47.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.675 178.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.06 169.3 25.03 Favored Glycine 0 CA--C 1.522 0.53 0 N-CA-C 111.346 -0.702 . . . . 0.0 111.346 -176.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -125.3 139.78 53.4 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.902 0.382 . . . . 0.0 110.894 -178.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 66.5 t90 -107.1 121.57 44.75 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.574 174.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.439 ' CD1' HG22 ' A' ' 31' ' ' VAL . 61.2 m-85 -111.74 140.19 46.58 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.131 0.269 . . . . 0.0 110.461 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.5 t80 -49.93 -37.72 33.03 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.793 178.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 46.3 t-20 -134.76 131.43 37.55 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.107 178.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.4 p -57.14 -38.24 73.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.884 -179.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -57.81 -44.84 86.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.524 0.678 . . . . 0.0 109.962 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -57.28 -45.28 84.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.026 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 47.5 t -59.3 -39.59 83.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.612 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -60.07 -46.26 90.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.908 0.385 . . . . 0.0 110.705 -177.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -59.96 -48.96 79.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.652 -177.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.673 HG23 HD11 ' A' ' 54' ' ' ILE . 31.7 mm -58.62 -44.74 90.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.037 -178.581 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 57.6 p -59.46 -43.82 93.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.739 -177.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.78 -44.74 94.08 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.687 -0.965 . . . . 0.0 110.687 -178.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.504 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.1 mt -58.32 -47.64 83.07 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.115 0.483 . . . . 0.0 110.501 -178.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 51.7 t -59.15 -43.41 89.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.137 -178.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -57.25 -41.95 80.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.907 0.384 . . . . 0.0 110.673 -178.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.55 -46.27 94.64 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 111.069 -0.812 . . . . 0.0 111.069 -179.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 72.4 mt -58.55 -42.62 88.29 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.943 0.401 . . . . 0.0 110.662 -179.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 48.1 mt -60.28 -40.39 90.27 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.82 -179.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 25.1 pttt -88.53 3.2 51.12 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 49.9 m -120.66 143.27 48.8 Favored 'General case' 0 C--O 1.231 0.116 0 O-C-N 122.021 -0.424 . . . . 0.0 110.42 179.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 59.4 mttp . . . . . 0 C--O 1.22 -0.45 0 CA-C-O 117.914 -1.041 . . . . 0.0 110.511 -179.837 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.277 0 N-CA-C 109.651 -1.38 . . . . 0.0 109.651 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -49.59 148.18 12.01 Favored 'Trans proline' 0 N--CA 1.496 1.664 0 CA-C-N 118.861 1.33 . . . . 0.0 112.001 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 97.4 mm-40 -99.08 143.04 29.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.563 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -67.38 153.83 94.08 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.547 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -70.03 -33.77 14.94 Favored 'Trans proline' 0 N--CA 1.494 1.546 0 C-N-CA 121.32 1.347 . . . . 0.0 112.057 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 78.7 mt -62.29 -40.34 95.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.743 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.3 mt -100.11 122.98 43.81 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.551 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -144.66 -44.91 0.24 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.482 179.369 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -59.42 -37.91 79.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.072 -179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -56.99 147.41 24.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.828 0.347 . . . . 0.0 110.747 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 38.3 ptt85 -71.43 133.07 45.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.935 -179.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.62 160.53 26.89 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.469 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -50.09 136.63 37.55 Favored 'Trans proline' 0 N--CA 1.496 1.65 0 C-N-CA 121.322 1.348 . . . . 0.0 111.751 179.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -103.21 150.03 37.52 Favored Pre-proline 0 C--O 1.236 0.356 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.779 -178.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 30.1 Cg_exo -57.9 128.96 30.98 Favored 'Trans proline' 0 N--CA 1.496 1.637 0 C-N-CA 121.032 1.155 . . . . 0.0 111.698 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 74.92 25.07 70.21 Favored Glycine 0 CA--C 1.531 1.057 0 CA-C-N 116.09 -0.504 . . . . 0.0 112.617 177.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 25.9 pt20 -52.02 150.31 4.43 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 117.762 0.781 . . . . 0.0 111.292 175.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 7.2 ttt -61.17 138.95 94.5 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-O 119.03 -0.509 . . . . 0.0 110.531 -175.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -76.3 160.88 35.52 Favored 'Trans proline' 0 N--CA 1.495 1.575 0 C-N-CA 121.396 1.397 . . . . 0.0 111.878 177.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -101.96 109.26 20.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.504 178.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1338 ' ' LEU . . . . . 0.428 HD12 ' CB ' ' A' ' 43' ' ' TRP . 13.5 mt -64.16 151.6 89.96 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.329 -0.396 . . . . 0.0 109.954 179.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -79.11 139.86 15.35 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 C-N-CA 121.229 1.286 . . . . 0.0 111.339 175.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 27.5 mmtp -97.13 125.76 44.69 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-O 118.889 -0.577 . . . . 0.0 110.225 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -74.09 155.72 47.33 Favored 'Trans proline' 0 N--CA 1.495 1.613 0 C-N-CA 121.429 1.419 . . . . 0.0 111.704 172.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -51.73 154.76 8.91 Favored 'Trans proline' 0 N--CA 1.494 1.554 0 C-N-CA 121.361 1.374 . . . . 0.0 111.783 178.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 26.0 tp -49.91 -29.17 7.76 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -177.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 64.7 t80 -54.93 -37.12 66.0 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.898 0.38 . . . . 0.0 111.228 -176.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1345 ' ' TRP . . . . . 0.441 ' HZ2' HD21 ' A' ' 94' ' ' LEU . 34.2 t90 -60.55 -48.14 83.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.261 -177.006 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -62.58 -48.8 77.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.119 0.485 . . . . 0.0 110.57 -177.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -59.2 -42.62 91.33 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.938 -176.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -59.12 -48.52 81.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.861 0.362 . . . . 0.0 110.594 -176.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.63 -48.94 79.71 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.601 -177.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -59.64 -41.6 90.85 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.174 -176.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 48.7 tptt -64.01 -47.42 80.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.093 -177.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -55.24 -48.92 73.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.204 -178.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -65.04 -35.24 80.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.501 179.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -85.72 125.41 33.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.843 0.354 . . . . 0.0 110.895 -178.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 5.7 mp . . . . . 0 C--O 1.221 -0.445 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.469 179.491 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.344 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_exo -48.82 149.47 7.61 Favored 'Trans proline' 0 N--CA 1.497 1.706 0 C-N-CA 121.323 1.349 . . . . 0.0 112.168 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -91.49 10.01 29.54 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 43.9 ttm -84.55 119.52 25.28 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-N 118.037 0.38 . . . . 0.0 110.576 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -94.27 103.2 15.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.63 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 23.5 p-10 -64.83 -38.62 91.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.03 179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 20.7 tp -56.55 -40.07 74.49 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.781 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.0 ttm -91.88 124.55 36.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.599 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.21 144.48 55.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.473 179.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.0 p30 -168.83 -175.1 2.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.821 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -59.94 -32.77 71.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.54 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.5 m -55.85 -39.57 71.62 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.899 0.38 . . . . 0.0 110.768 -178.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mm -60.29 -47.08 93.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.991 0.424 . . . . 0.0 110.051 -178.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 35.3 m -58.98 -44.62 91.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.448 -177.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -59.22 -45.0 92.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.608 -178.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 44.1 ttm -58.34 -44.01 88.53 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.025 0.44 . . . . 0.0 110.319 -178.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 29.7 m120 -60.13 -49.62 76.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.271 -178.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.698 ' HA ' HD12 ' A' ' 14' ' ' ILE . 10.8 tp -59.62 -33.25 71.27 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.066 -178.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.04 -50.35 70.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.632 0.254 . . . . 0.0 110.798 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.04 -41.77 83.97 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.018 0.437 . . . . 0.0 110.455 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.698 HD12 ' HA ' ' A' ' 11' ' ' LEU . 94.9 mt -54.16 -52.96 32.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.66 178.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -52.51 -23.69 6.7 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -178.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.1 tttm -59.0 -33.65 70.95 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 -177.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.9 mm -109.89 -42.9 5.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.942 0.401 . . . . 0.0 110.204 -177.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -116.85 80.07 10.66 Favored Pre-proline 0 CA--C 1.535 0.375 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.341 -176.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_exo -54.2 -22.59 26.43 Favored 'Trans proline' 0 N--CA 1.498 1.741 0 C-N-CA 121.533 1.489 . . . . 0.0 113.379 -176.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -92.1 14.42 16.04 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 -174.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -91.78 121.46 33.43 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 173.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.622 ' O ' HD21 ' A' ' 11' ' ' LEU . 22.9 tptm -104.37 -39.83 6.31 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.135 -172.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.5 tt0 -134.31 147.72 50.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.099 -176.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.415 HD11 HD12 ' A' ' 14' ' ' ILE . 22.6 mt -99.6 133.25 43.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 172.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.8 t -92.48 -47.25 14.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 109.983 179.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.5 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.0 t0 -153.07 151.15 29.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.84 178.331 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.1 p -139.02 132.04 29.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.059 0.457 . . . . 0.0 110.925 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.6 t -106.28 125.83 51.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.63 176.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.7 m -54.04 -37.85 64.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.241 -173.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 64.6 t-80 -151.52 126.94 10.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.331 0.586 . . . . 0.0 111.737 -179.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.41 HG21 ' HB3' ' A' ' 52' ' ' PHE . 94.8 t -144.97 140.83 23.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.399 -178.128 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.48 149.92 51.05 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.211 -177.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -98.32 131.96 44.19 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 121.35 0.595 . . . . 0.0 111.889 -176.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -124.58 143.18 50.84 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.6 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 86.1 m -121.94 144.76 48.68 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -106.5 131.96 53.07 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 120.881 0.372 . . . . 0.0 110.116 175.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 -103.62 115.05 29.79 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.828 177.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 22.7 t -67.93 -32.56 73.1 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.958 -176.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.4 m -60.29 -39.06 85.55 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.663 0.268 . . . . 0.0 110.996 -177.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -95.82 -21.46 18.09 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 69.71 44.37 0.87 Allowed 'General case' 0 C--O 1.232 0.181 0 CA-C-O 121.402 0.62 . . . . 0.0 109.697 -178.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -150.4 162.68 40.09 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.143 -177.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.413 ' CB ' HD12 ' B' 1338 ' ' LEU . 85.3 m95 -94.94 140.08 30.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.403 178.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -122.26 130.33 53.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.076 177.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.9 pttp -75.43 139.27 42.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.293 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.7 p -92.33 169.4 10.61 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.651 -0.419 . . . . 0.0 109.95 178.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.1 p30 -85.79 13.11 7.73 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 177.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 40.2 t -104.11 106.44 20.32 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-O 121.025 0.441 . . . . 0.0 110.313 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.8 tt0 -130.76 114.59 15.54 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 176.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -161.94 176.47 38.38 Favored Glycine 0 CA--C 1.519 0.338 0 C-N-CA 120.099 -1.048 . . . . 0.0 112.451 -169.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.517 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -79.71 136.28 36.74 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 175.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.41 ' HB3' HG21 ' A' ' 31' ' ' VAL . 4.8 t80 -101.44 123.5 45.6 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 120.952 -0.299 . . . . 0.0 110.23 -176.34 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.517 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 5.0 m-85 -128.25 141.16 51.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.629 0.252 . . . . 0.0 110.658 177.057 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.425 HD11 HG23 ' A' ' 116' ' ' ILE . 74.6 mt -101.5 127.06 55.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 171.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.627 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 12.3 m-30 -108.55 138.94 44.03 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.956 0.408 . . . . 0.0 111.346 -177.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 61.5 t60 -108.81 143.38 38.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.912 174.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 64.3 ttt180 -140.47 145.85 37.46 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.025 177.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.9 m120 -86.97 28.18 0.94 Allowed 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.268 -0.423 . . . . 0.0 112.045 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.31 166.09 33.17 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 179.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -64.05 127.91 92.4 Favored Pre-proline 0 CA--C 1.54 0.574 0 CA-C-O 118.463 -0.779 . . . . 0.0 109.949 -177.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -75.66 140.98 69.52 Favored 'Cis proline' 0 N--CA 1.497 1.702 0 CA-C-N 121.835 1.691 . . . . 0.0 111.741 -1.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -62.73 -41.87 99.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.955 -177.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.403 ' HB3' HD12 ' A' ' 80' ' ' ILE . 73.5 m80 -143.25 139.55 30.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.359 0.6 . . . . 0.0 110.908 -177.079 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.4 t -149.99 151.76 33.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.345 -178.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 51.7 mt -114.68 138.92 43.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 -177.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -131.82 142.16 49.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.391 -178.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.5 mt -121.07 129.63 75.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.248 0.547 . . . . 0.0 109.738 172.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -97.21 99.54 11.02 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.001 -1.0 . . . . 0.0 109.492 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -73.31 106.06 4.97 Favored 'General case' 0 C--N 1.332 -0.188 0 O-C-N 123.702 0.626 . . . . 0.0 111.013 -175.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.2 ttm180 -72.85 -43.39 62.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.416 -171.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 52.6 mt -70.3 -45.25 66.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.605 -174.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 39.0 m-20 -95.1 -3.17 48.57 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -175.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 67.4 p 51.63 43.15 30.01 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.55 0.69 . . . . 0.0 110.996 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.1 m -124.85 142.02 51.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.277 -179.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.3 p -88.58 133.66 34.1 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.389 -178.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -123.69 122.09 37.19 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 175.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.8 p -125.57 147.34 30.3 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 120.836 0.35 . . . . 0.0 111.109 -178.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -149.8 126.49 5.31 Favored Pre-proline 0 CA--C 1.539 0.534 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.203 175.214 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -75.39 150.91 37.17 Favored 'Trans proline' 0 N--CA 1.499 1.813 0 C-N-CA 121.371 1.38 . . . . 0.0 112.067 178.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.403 HD12 ' HB3' ' A' ' 63' ' ' HIS . 64.9 mt -89.78 115.81 30.03 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.113 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.328 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 66.0 p -97.92 159.01 15.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.94 176.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -95.4 24.96 26.79 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.817 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.3 p -111.07 -10.9 14.33 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 175.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.0 mt -67.96 135.16 51.94 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.856 0.36 . . . . 0.0 111.423 -175.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -111.05 135.92 50.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.768 175.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 66.6 mt -113.91 161.15 17.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.998 0.428 . . . . 0.0 111.056 -175.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -150.04 140.93 22.82 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 177.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.2 t -102.27 109.2 20.81 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.582 -0.447 . . . . 0.0 111.046 -178.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -106.82 103.75 48.52 Favored Pre-proline 0 C--N 1.329 -0.301 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 170.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -69.56 141.85 47.16 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 CA-C-N 120.654 1.269 . . . . 0.0 111.811 -172.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -90.08 11.94 57.5 Favored 'Cis proline' 0 N--CA 1.499 1.816 0 CA-C-N 121.068 1.417 . . . . 0.0 113.628 -3.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -90.86 169.54 10.84 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.686 0.279 . . . . 0.0 110.765 -178.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 50.7 tp -118.77 134.66 54.98 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 171.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.434 HD11 ' CG2' ' A' ' 102' ' ' ILE . 9.3 tp -125.58 140.37 52.79 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.637 0.256 . . . . 0.0 110.426 -175.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 22.2 p90 -145.42 155.09 42.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.787 0.327 . . . . 0.0 110.239 175.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.1 mtm105 -101.98 147.75 26.18 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.877 0.37 . . . . 0.0 110.624 -177.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -128.85 165.65 20.58 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.731 0.777 . . . . 0.0 111.523 -176.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -47.11 146.93 1.6 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.553 -0.748 . . . . 0.0 112.285 -177.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 63.33 30.92 15.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.227 179.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.5 p 66.26 35.25 6.05 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.729 0.3 . . . . 0.0 111.685 166.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -98.87 152.78 19.37 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.434 ' CG2' HD11 ' A' ' 94' ' ' LEU . 86.5 mt -115.46 126.96 73.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -178.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -133.92 150.24 51.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.58 178.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -141.6 167.38 25.89 Favored Glycine 0 CA--C 1.522 0.524 0 N-CA-C 111.351 -0.7 . . . . 0.0 111.351 -176.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 28.3 m-85 -125.38 139.53 53.59 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.517 -0.341 . . . . 0.0 110.663 -179.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 7.6 t90 -107.16 125.72 51.46 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.417 174.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -113.52 141.8 46.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.792 0.329 . . . . 0.0 110.625 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -51.43 -35.32 38.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.691 178.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.2 t-20 -137.38 136.75 38.17 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.755 0.312 . . . . 0.0 110.403 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 25.1 m -61.38 -42.56 98.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.107 -177.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 -57.84 -43.2 85.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.368 0.604 . . . . 0.0 110.106 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -57.03 -45.9 82.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.869 178.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 43.0 t -59.6 -37.74 79.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.889 178.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -61.73 -50.08 73.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.656 0.265 . . . . 0.0 110.856 -175.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -61.65 -44.75 96.38 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.987 -176.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.496 ' HA ' HD12 ' A' ' 119' ' ' LEU . 23.1 mm -59.52 -46.86 92.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 19.3 m -58.55 -44.62 89.71 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.563 -177.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.39 -43.33 93.91 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 -178.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.5 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.7 mt -58.25 -49.45 77.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.143 0.497 . . . . 0.0 110.489 -178.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 54.5 t -58.8 -43.87 89.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.171 -177.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -59.05 -42.3 89.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.825 -178.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.94 -41.94 99.7 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 111.407 -0.677 . . . . 0.0 111.407 -178.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 20.8 mt -63.67 -43.54 96.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.788 0.328 . . . . 0.0 111.181 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 66.9 mt -63.05 -44.88 94.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.437 -176.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 33.0 pttt -71.65 -37.52 70.81 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.754 -0.378 . . . . 0.0 111.28 -177.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 71.2 p -89.75 159.87 16.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.912 0.387 . . . . 0.0 110.519 -179.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 67.7 tttt . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 117.968 -1.015 . . . . 0.0 110.548 179.889 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.39 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -69.38 144.53 56.36 Favored 'Trans proline' 0 N--CA 1.495 1.592 0 C-N-CA 121.296 1.331 . . . . 0.0 111.97 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -101.44 152.31 20.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.625 -179.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 14.9 p30 -67.01 155.46 90.18 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.64 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -78.38 -0.94 11.16 Favored 'Trans proline' 0 N--CA 1.496 1.649 0 C-N-CA 121.331 1.354 . . . . 0.0 113.882 -179.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 21.4 tp -56.73 -42.01 78.47 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.825 0.345 . . . . 0.0 110.554 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 27.8 tp -64.74 -39.08 93.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.899 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 98.3 mm-40 -60.0 131.5 51.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.835 0.35 . . . . 0.0 110.748 -179.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.83 -39.23 93.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.891 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -56.94 145.85 28.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.862 0.363 . . . . 0.0 110.7 -179.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 68.4 ttt180 -74.62 137.85 42.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.491 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -71.92 157.06 90.24 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.695 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -68.26 133.19 27.78 Favored 'Trans proline' 0 N--CA 1.496 1.672 0 C-N-CA 121.272 1.315 . . . . 0.0 111.919 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 47.7 t80 -104.06 140.19 20.83 Favored Pre-proline 0 CA--C 1.532 0.272 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.909 -179.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -57.92 128.95 30.92 Favored 'Trans proline' 0 N--CA 1.497 1.705 0 C-N-CA 121.053 1.169 . . . . 0.0 111.558 -179.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 103.42 -5.2 48.28 Favored Glycine 0 CA--C 1.535 1.316 0 CA-C-O 119.509 -0.606 . . . . 0.0 113.348 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -77.23 137.61 38.93 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 118.324 1.062 . . . . 0.0 110.225 176.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 4.3 ttp -68.44 133.65 91.03 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-O 118.717 -0.659 . . . . 0.0 110.003 -178.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -56.16 144.06 82.12 Favored 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 121.133 1.222 . . . . 0.0 111.506 175.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -99.14 101.22 12.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.608 -179.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1338 ' ' LEU . . . . . 0.413 HD12 ' CB ' ' A' ' 43' ' ' TRP . 16.1 mt -66.72 147.1 99.12 Favored Pre-proline 0 C--N 1.329 -0.288 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 179.126 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -79.14 139.82 15.26 Favored 'Trans proline' 0 N--CA 1.491 1.351 0 C-N-CA 121.166 1.244 . . . . 0.0 111.215 174.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 2.3 mmmp? -97.2 125.78 44.46 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-O 118.796 -0.621 . . . . 0.0 109.861 178.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -75.09 163.43 35.15 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 C-N-CA 121.425 1.417 . . . . 0.0 111.694 173.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.56 157.2 32.9 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 121.341 1.36 . . . . 0.0 111.341 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 26.4 tp -50.06 -27.61 5.85 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -176.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -54.61 -36.7 64.74 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.867 0.365 . . . . 0.0 111.294 -177.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 39.2 t90 -61.08 -48.13 83.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.247 -177.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -61.2 -46.35 90.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.051 0.453 . . . . 0.0 110.477 -178.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -59.35 -44.71 92.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.722 -177.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -58.28 -46.33 86.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.451 -176.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.07 -47.74 84.6 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.631 -178.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -58.33 -41.65 85.08 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.951 -177.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 23.2 tptm -64.42 -48.19 76.29 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.995 -178.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -54.92 -46.43 74.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.152 -178.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 42.8 tp10 -64.9 -37.01 86.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.076 178.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -63.99 148.82 48.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.76 0.314 . . . . 0.0 110.607 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 78.1 mt . . . . . 0 C--O 1.22 -0.485 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.554 179.958 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.252 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.1 -32.32 48.77 Favored 'Trans proline' 0 N--CA 1.495 1.59 0 CA-C-N 118.854 1.327 . . . . 0.0 112.167 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 70.9 t60 -61.29 -51.1 70.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.722 -179.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 64.8 mtt -140.82 145.88 36.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.54 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -97.28 141.86 29.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.651 -179.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -140.28 100.19 3.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.425 179.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 79.1 mt -57.37 -43.27 83.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.653 -179.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.7 mtm -142.25 159.13 42.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.605 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -63.94 148.24 50.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.489 179.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -148.13 161.86 40.58 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.708 -179.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -59.85 -36.55 77.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.192 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.5 p -58.48 -37.86 76.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.756 0.312 . . . . 0.0 110.941 -178.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 43.7 mm -62.29 -40.78 89.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.372 179.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.9 m -63.49 -49.97 71.47 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.679 -176.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 34.7 ptt180 -61.88 -37.45 84.61 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.799 -178.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 44.0 ttm -58.68 -46.21 87.72 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.151 0.5 . . . . 0.0 110.143 179.252 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -59.67 -48.92 79.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.195 -178.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.687 ' HA ' HD12 ' A' ' 14' ' ' ILE . 9.3 tp -59.74 -32.97 71.06 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.651 -0.419 . . . . 0.0 111.177 -178.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.84 -50.53 70.59 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.654 0.264 . . . . 0.0 110.701 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.64 -41.74 86.7 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.43 179.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.687 HD12 ' HA ' ' A' ' 11' ' ' LEU . 95.3 mt -54.19 -52.94 33.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.649 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -54.15 -21.6 9.17 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -178.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -58.64 -33.96 70.66 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 111.727 0.269 . . . . 0.0 111.727 -178.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.699 HG21 ' CB ' ' A' ' 75' ' ' SER . 46.6 mm -113.0 -40.15 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-O 120.722 0.296 . . . . 0.0 110.531 -177.015 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -117.05 77.38 8.99 Favored Pre-proline 0 CA--C 1.535 0.368 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.214 -178.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -55.39 -20.71 26.86 Favored 'Trans proline' 0 N--CA 1.498 1.76 0 C-N-CA 121.536 1.49 . . . . 0.0 113.459 -175.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.8 p90 -90.77 9.94 28.04 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 -174.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -84.62 122.32 28.88 Favored 'General case' 0 C--O 1.231 0.11 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 174.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.409 ' O ' HD21 ' A' ' 11' ' ' LEU . 31.4 ttpt -97.49 -40.54 8.61 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.887 -173.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -148.44 153.06 38.0 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.586 -0.445 . . . . 0.0 111.433 -178.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 29.9 mt -94.38 138.3 20.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.848 178.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.2 t -92.58 -47.17 14.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.839 177.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.502 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.9 t0 -152.88 155.06 36.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.019 178.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.8 p -141.86 132.02 24.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.044 0.449 . . . . 0.0 110.943 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.5 t -108.49 126.45 52.93 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.647 177.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.4 t -54.58 -38.85 67.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.28 -172.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -150.45 126.8 10.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.225 0.536 . . . . 0.0 111.558 -179.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.456 HG22 ' CD2' ' A' ' 107' ' ' PHE . 96.2 t -145.19 140.43 22.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.309 -177.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.64 149.76 51.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.725 0.298 . . . . 0.0 111.314 -177.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.511 ' HD2' HG21 ' A' ' 46' ' ' THR . 36.4 t80 -98.63 130.83 45.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.27 -177.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -125.31 142.08 51.71 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.599 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.579 HG23 ' CZ ' ' A' ' 103' ' ' ARG . 64.1 m -120.38 145.86 46.75 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 178.342 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -108.27 131.87 54.26 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 121.011 0.434 . . . . 0.0 110.433 176.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -104.11 115.45 30.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.888 177.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 15.0 t -67.63 -32.51 73.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.918 -177.307 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.1 t -60.44 -40.26 90.44 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.726 0.298 . . . . 0.0 110.82 -177.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 98.0 mm-40 -93.8 -21.36 19.34 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 69.66 43.48 0.98 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-O 121.436 0.636 . . . . 0.0 109.803 -177.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -151.51 162.97 40.05 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.037 -177.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.456 ' CB ' HD12 ' B' 1338 ' ' LEU . 89.0 m95 -94.33 141.76 28.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.336 177.507 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -124.01 130.42 52.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 0.0 109.958 176.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -72.42 139.21 47.65 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 177.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.511 HG21 ' HD2' ' A' ' 33' ' ' PHE . 77.3 p -92.35 179.04 5.66 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.298 -178.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -88.67 15.17 8.57 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -179.081 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.4 t -111.88 106.42 20.73 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 CA-C-O 120.982 0.42 . . . . 0.0 110.273 178.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -132.19 112.93 12.7 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 174.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.52 38.96 Favored Glycine 0 CA--C 1.52 0.4 0 C-N-CA 120.202 -0.999 . . . . 0.0 112.213 -168.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.478 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -78.47 135.95 37.49 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 174.647 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.419 ' HB3' HG21 ' A' ' 31' ' ' VAL . 6.3 t80 -101.26 127.04 48.03 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.346 -175.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.478 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 6.5 m-85 -130.76 142.09 50.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.765 0.316 . . . . 0.0 110.308 177.143 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.699 HD11 HG23 ' A' ' 116' ' ' ILE . 66.3 mt -101.62 127.58 54.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 172.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.672 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.2 m-30 -108.48 137.62 46.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.997 0.427 . . . . 0.0 111.208 -175.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 30.1 t60 -116.7 143.31 45.79 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.967 175.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -141.22 147.43 38.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.141 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -86.9 28.1 0.93 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.275 -0.421 . . . . 0.0 112.125 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.72 160.5 37.97 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 178.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -64.05 131.78 95.08 Favored Pre-proline 0 CA--C 1.539 0.547 0 CA-C-O 118.536 -0.745 . . . . 0.0 110.04 -176.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -71.13 140.88 67.16 Favored 'Cis proline' 0 N--CA 1.498 1.792 0 CA-C-N 121.701 1.643 . . . . 0.0 111.515 -1.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -65.22 -42.73 93.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.028 -177.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -143.52 140.97 30.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.494 0.664 . . . . 0.0 111.038 -177.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.3 t -150.42 152.39 34.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.211 -178.024 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 46.5 mt -112.58 138.13 42.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -178.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 79.2 t80 -131.83 142.02 49.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.972 -176.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.0 mt -123.62 133.23 69.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.18 0.514 . . . . 0.0 109.847 172.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -99.16 99.55 10.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.37 179.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -72.42 106.95 4.74 Favored 'General case' 0 C--N 1.332 -0.193 0 O-C-N 123.666 0.604 . . . . 0.0 111.092 -175.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 55.6 ttp180 -72.86 -41.04 65.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.198 -171.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 75.5 mt -70.51 -45.16 66.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.684 -175.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -95.01 -3.34 48.57 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.731 1.012 . . . . 0.0 113.731 -175.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.43 HG22 ' O ' ' A' ' 73' ' ' THR . 13.0 m 55.87 43.1 28.11 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 121.452 0.644 . . . . 0.0 110.57 177.064 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.6 m -131.78 149.03 52.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.229 -178.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.699 ' CB ' HG21 ' A' ' 17' ' ' ILE . 4.0 p -101.71 141.82 33.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.929 0.395 . . . . 0.0 110.933 -179.087 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -135.45 122.13 20.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.231 178.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.8 p -125.49 148.53 30.02 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 CA-C-O 120.807 0.337 . . . . 0.0 111.035 -177.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -147.17 136.27 11.48 Favored Pre-proline 0 CA--C 1.537 0.456 0 CA-C-O 119.03 -0.509 . . . . 0.0 110.487 174.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.51 150.87 36.61 Favored 'Trans proline' 0 N--CA 1.498 1.736 0 C-N-CA 121.673 1.582 . . . . 0.0 112.411 179.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 68.8 mt -89.96 137.25 21.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.902 0.382 . . . . 0.0 110.165 177.118 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 61.6 p -132.15 159.47 38.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.866 177.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -95.79 36.04 4.03 Favored Glycine 0 CA--C 1.524 0.653 0 C-N-CA 120.845 -0.693 . . . . 0.0 111.914 -178.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.2 t -109.22 -21.97 12.31 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 174.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 74.8 mt -68.49 144.93 54.47 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-O 120.949 0.404 . . . . 0.0 111.492 -176.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 54.2 tt0 -114.78 135.87 53.71 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.715 175.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 67.6 mt -115.16 158.09 22.72 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.057 0.456 . . . . 0.0 111.11 -175.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -149.54 141.02 23.34 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 177.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 31.4 t -98.13 109.09 21.9 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.399 -0.521 . . . . 0.0 110.578 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -106.83 103.68 48.22 Favored Pre-proline 0 C--N 1.328 -0.355 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 172.118 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -71.41 142.22 40.41 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 CA-C-N 120.596 1.249 . . . . 0.0 112.025 -171.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -90.56 13.72 52.58 Favored 'Cis proline' 0 N--CA 1.499 1.844 0 CA-C-N 121.075 1.42 . . . . 0.0 113.541 -3.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -93.04 172.98 7.97 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 122.149 0.179 . . . . 0.0 110.721 -177.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 58.7 tp -115.94 135.7 53.73 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 171.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 10.2 tp -127.15 139.63 52.83 Favored 'General case' 0 C--N 1.334 -0.096 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 -174.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 9.4 p90 -148.84 153.79 38.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.951 0.405 . . . . 0.0 110.659 176.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 31.6 mtm180 -102.43 149.21 24.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.81 -176.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -129.73 166.53 19.68 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.791 0.805 . . . . 0.0 111.464 -177.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -47.77 145.01 3.01 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.249 -176.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 65.24 31.01 11.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.093 179.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 37.8 t 66.29 35.14 6.06 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.912 0.387 . . . . 0.0 111.578 166.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -98.25 152.77 19.06 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 179.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 78.0 mt -115.77 126.28 73.24 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 CA-C-O 121.061 0.458 . . . . 0.0 109.993 -177.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.579 ' CZ ' HG23 ' A' ' 35' ' ' THR . 85.7 mmt-85 -127.95 149.4 50.35 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.276 178.123 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -140.54 164.69 26.27 Favored Glycine 0 CA--C 1.522 0.517 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 -178.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 32.9 m-85 -125.35 136.65 53.67 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.442 -0.379 . . . . 0.0 110.856 -178.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -107.41 126.35 52.38 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.735 175.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.456 ' CD2' HG22 ' A' ' 31' ' ' VAL . 62.8 m-85 -117.84 142.67 47.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.799 0.333 . . . . 0.0 110.51 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -51.15 -34.72 32.37 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.769 178.252 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -137.62 136.92 37.96 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.767 0.318 . . . . 0.0 110.469 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.0 p -61.69 -40.48 95.15 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.161 -177.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -59.72 -43.67 94.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.407 0.622 . . . . 0.0 110.095 178.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -56.73 -45.32 82.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.979 179.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 43.0 t -60.22 -39.69 87.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.728 178.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -59.21 -45.65 90.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.77 0.319 . . . . 0.0 110.562 -176.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -60.62 -49.04 79.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.744 -177.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.699 HG23 HD11 ' A' ' 54' ' ' ILE . 31.6 mm -58.46 -44.98 90.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.039 -178.374 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 68.1 p -59.74 -44.37 93.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.767 -177.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.7 -43.79 94.32 Favored Glycine 0 CA--C 1.523 0.585 0 N-CA-C 110.678 -0.969 . . . . 0.0 110.678 -178.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.502 HD13 ' HB2' ' A' ' 26' ' ' ASP . 11.2 mt -59.06 -48.72 80.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.034 0.445 . . . . 0.0 110.506 -178.323 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.403 HG12 HD11 ' A' ' 124' ' ' LEU . 53.3 t -58.82 -43.24 87.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.168 -178.502 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -57.97 -43.0 86.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.681 -178.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.5 -42.77 99.67 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.407 -0.677 . . . . 0.0 111.407 -178.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 34.4 mt -63.94 -40.74 97.14 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.765 0.317 . . . . 0.0 111.403 -179.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.403 HD11 HG12 ' A' ' 120' ' ' VAL . 29.8 mt -62.8 -38.18 89.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.687 -176.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 32.7 pttt -84.3 -34.38 23.75 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.875 -175.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 49.2 m -110.68 143.59 40.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.857 0.36 . . . . 0.0 110.936 -177.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm . . . . . 0 C--O 1.22 -0.476 0 CA-C-O 118.007 -0.997 . . . . 0.0 110.567 179.819 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -49.05 144.46 15.94 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 121.37 1.38 . . . . 0.0 112.034 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -100.14 144.65 28.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.505 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 21.8 p-10 -70.32 153.42 95.18 Favored Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.6 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -83.33 159.95 15.05 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 121.544 1.496 . . . . 0.0 112.219 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 29.9 tp -56.92 -41.04 77.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.634 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 22.8 tp -101.04 124.53 46.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.51 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 52.7 tp60 -102.27 111.69 24.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.594 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -66.94 -39.85 87.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.888 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -89.7 157.34 18.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.729 -178.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 59.8 ttt85 -84.78 127.15 33.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.582 179.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.6 159.5 30.64 Favored Pre-proline 0 CA--C 1.532 0.263 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.459 179.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -68.16 145.12 65.64 Favored 'Trans proline' 0 N--CA 1.496 1.658 0 C-N-CA 121.233 1.289 . . . . 0.0 111.768 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -96.6 152.13 38.38 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.691 -179.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -57.98 129.0 31.07 Favored 'Trans proline' 0 N--CA 1.496 1.623 0 C-N-CA 121.093 1.195 . . . . 0.0 111.502 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 98.61 -2.17 58.71 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 121.05 -0.595 . . . . 0.0 113.403 179.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -52.02 133.75 32.67 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 118.426 1.113 . . . . 0.0 111.378 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 6.6 ttt -69.5 118.16 59.78 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-O 118.624 -0.703 . . . . 0.0 110.461 -178.364 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -59.28 152.88 57.15 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 C-N-CA 121.14 1.227 . . . . 0.0 111.621 175.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 7.5 p30 -98.59 114.84 27.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.745 -179.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1338 ' ' LEU . . . . . 0.456 HD12 ' CB ' ' A' ' 43' ' ' TRP . 15.4 mt -71.19 153.63 94.23 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.123 178.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.05 139.96 15.51 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 C-N-CA 121.154 1.236 . . . . 0.0 111.145 174.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -97.12 125.83 44.47 Favored Pre-proline 0 CA--C 1.534 0.365 0 CA-C-O 118.782 -0.628 . . . . 0.0 109.97 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -77.79 154.9 30.57 Favored 'Trans proline' 0 N--CA 1.494 1.52 0 C-N-CA 121.415 1.41 . . . . 0.0 111.438 173.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -50.54 151.18 10.64 Favored 'Trans proline' 0 N--CA 1.496 1.647 0 C-N-CA 121.263 1.309 . . . . 0.0 111.747 178.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 79.5 mt -49.94 -25.83 3.62 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 -177.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -55.54 -38.49 69.35 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.904 0.383 . . . . 0.0 111.059 -177.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 33.3 t90 -61.81 -48.11 82.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.269 -176.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 37.6 tt0 -61.37 -48.2 82.34 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.073 0.463 . . . . 0.0 110.532 -177.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -59.86 -45.32 92.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 -177.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.1 tt0 -58.76 -46.45 87.44 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.669 -176.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.53 -48.43 81.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.765 -177.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -59.06 -42.29 89.95 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.104 -176.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 48.9 tttm -64.93 -48.1 75.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.139 -177.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 55.5 tp60 -55.01 -47.97 73.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.139 -178.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -64.91 -37.08 86.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.095 179.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -70.06 153.93 42.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.83 0.347 . . . . 0.0 110.558 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 23.7 tp . . . . . 0 C--O 1.221 -0.44 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.475 179.925 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.267 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -52.38 -30.71 44.46 Favored 'Trans proline' 0 N--CA 1.497 1.712 0 CA-C-N 119.558 1.679 . . . . 0.0 112.304 177.466 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -55.63 -39.81 71.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.944 -179.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 71.5 mtm -82.08 134.07 35.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.663 -179.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -75.23 174.63 9.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.4 179.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 26.3 p-10 -71.26 104.78 3.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.305 0.574 . . . . 0.0 110.68 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 28.9 tp -69.09 -39.88 78.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.824 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.2 mmm -75.82 135.0 40.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.479 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.24 172.84 12.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.511 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.32 153.19 27.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.658 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -59.54 -35.97 75.24 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.139 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.8 t -56.57 -40.47 75.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.892 0.377 . . . . 0.0 110.659 -178.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.0 mm -60.09 -45.71 95.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.215 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.2 m -59.24 -45.66 90.57 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.024 0.44 . . . . 0.0 110.509 -177.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -59.38 -44.57 92.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.574 -178.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 44.5 ttm -58.26 -43.53 87.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.102 0.477 . . . . 0.0 110.463 -178.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -60.06 -49.5 77.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.299 -178.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.751 ' HA ' HD12 ' A' ' 14' ' ' ILE . 13.7 tp -61.32 -30.86 70.76 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.394 -179.144 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.85 -50.17 71.99 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.745 0.307 . . . . 0.0 110.619 178.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.44 -41.49 85.24 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.945 0.402 . . . . 0.0 110.392 178.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.751 HD12 ' HA ' ' A' ' 11' ' ' LEU . 95.5 mt -54.22 -52.95 33.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.659 178.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -53.3 -24.29 11.29 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.578 0.585 . . . . 0.0 112.578 -178.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -59.87 -33.52 71.93 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -177.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.5 mm -108.34 -40.69 4.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.787 0.327 . . . . 0.0 110.532 -176.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -114.78 84.94 10.89 Favored Pre-proline 0 CA--C 1.533 0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.713 -176.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -53.51 -22.97 23.33 Favored 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 121.522 1.482 . . . . 0.0 113.194 -178.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.4 p90 -97.98 22.06 9.84 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -175.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -101.81 121.23 41.7 Favored 'General case' 0 C--O 1.231 0.105 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 171.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.483 ' O ' HD21 ' A' ' 11' ' ' LEU . 51.1 tptt -110.95 -38.15 5.18 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.761 0.315 . . . . 0.0 111.272 -173.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 86.4 tt0 -130.02 144.82 51.54 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.808 -176.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.471 HG13 HD13 ' A' ' 11' ' ' LEU . 59.4 mt -98.7 129.21 49.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.83 173.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.1 t -90.46 -47.11 14.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 0.0 109.914 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.494 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -153.37 152.13 30.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.129 178.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.7 p -140.82 131.96 26.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.992 0.425 . . . . 0.0 110.775 178.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.9 t -107.02 129.18 54.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.901 177.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.3 m -54.41 -38.3 66.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.269 -172.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 -152.41 127.53 9.77 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.323 0.583 . . . . 0.0 111.91 -178.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.469 HG22 ' CD2' ' A' ' 107' ' ' PHE . 98.4 t -145.2 140.69 22.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.466 -178.089 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -128.41 149.83 50.38 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.159 -178.079 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -97.03 132.78 42.49 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.204 0.526 . . . . 0.0 111.723 -177.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -128.16 142.85 51.06 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.668 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.3 m -121.5 148.09 44.92 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 177.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -112.48 131.69 55.45 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-O 120.865 0.364 . . . . 0.0 110.357 177.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -102.01 113.78 27.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.775 176.332 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 85.6 p -68.56 -31.02 69.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.074 -177.018 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.2 m -62.6 -38.58 90.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.667 0.27 . . . . 0.0 110.928 -177.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 97.8 mm-40 -94.68 -21.41 18.79 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -178.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 69.58 45.66 0.78 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.463 0.649 . . . . 0.0 109.434 -177.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 -151.89 149.69 29.24 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.233 -177.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.458 ' CB ' HD12 ' B' 1338 ' ' LEU . 82.7 m95 -86.98 142.46 27.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.199 176.57 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -123.78 126.29 46.21 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 175.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -75.51 140.35 42.73 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 178.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.8 p -92.29 170.72 9.57 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.144 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -84.37 12.43 6.77 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 178.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 40.4 t -104.39 106.48 20.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-O 120.969 0.414 . . . . 0.0 110.215 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -130.7 116.1 17.57 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 176.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.55 176.39 38.89 Favored Glycine 0 CA--C 1.521 0.443 0 C-N-CA 120.081 -1.056 . . . . 0.0 112.441 -169.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.476 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -80.22 136.63 36.51 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 175.254 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.401 ' HB3' HG21 ' A' ' 31' ' ' VAL . 4.5 t80 -101.8 125.31 48.44 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.293 -175.37 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.476 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 4.9 m-85 -129.46 141.57 50.99 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.791 0.329 . . . . 0.0 110.712 177.015 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.614 HD11 HG23 ' A' ' 116' ' ' ILE . 67.9 mt -101.58 126.38 55.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 171.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.654 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 11.6 m-30 -108.57 138.05 45.51 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.892 0.377 . . . . 0.0 111.335 -177.261 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 61.9 t60 -111.6 143.25 42.78 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.871 173.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 13.4 tpt180 -142.22 147.71 36.97 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.884 177.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -86.9 28.18 0.93 Allowed 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.73 171.3 20.33 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.1 mp0 -63.99 124.38 85.01 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-O 118.45 -0.786 . . . . 0.0 110.003 -178.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -79.41 140.97 59.01 Favored 'Cis proline' 0 N--CA 1.497 1.685 0 CA-C-N 121.937 1.728 . . . . 0.0 111.926 -0.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -63.2 -44.26 95.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.941 -177.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -143.32 135.86 27.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.307 0.575 . . . . 0.0 110.837 -177.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.4 t -149.6 150.91 32.94 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.572 -177.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.466 HG13 HD11 ' A' ' 80' ' ' ILE . 57.7 mt -114.32 137.46 47.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 -178.255 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -131.94 142.16 49.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.581 -177.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.5 mt -120.05 129.41 75.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.247 0.546 . . . . 0.0 109.729 172.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -96.58 99.52 11.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.531 -179.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.2 t-20 -71.23 105.45 3.45 Favored 'General case' 0 N--CA 1.462 0.151 0 O-C-N 123.642 0.589 . . . . 0.0 110.971 -175.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -73.1 -42.43 62.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.235 -171.052 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 60.4 mt -70.9 -45.21 64.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.624 -174.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 54.8 m-20 -95.11 -3.27 48.36 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -175.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.0 m 55.71 43.52 27.83 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 121.452 0.644 . . . . 0.0 110.452 177.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.6 m -125.16 148.87 48.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.52 -178.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.3 p -97.3 132.53 42.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.346 -179.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -123.59 122.1 37.29 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 175.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 12.8 p -125.54 147.68 30.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-O 120.751 0.31 . . . . 0.0 111.237 -178.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -149.77 126.55 5.34 Favored Pre-proline 0 CA--C 1.537 0.473 0 CA-C-O 118.665 -0.684 . . . . 0.0 110.213 174.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -75.27 150.94 37.71 Favored 'Trans proline' 0 N--CA 1.498 1.765 0 C-N-CA 121.46 1.44 . . . . 0.0 112.265 178.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.466 HD11 HG13 ' A' ' 65' ' ' ILE . 67.0 mt -90.65 138.92 18.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 120.929 0.395 . . . . 0.0 110.302 178.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.4 p -132.1 155.65 47.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.706 177.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -94.04 36.68 3.65 Favored Glycine 0 CA--C 1.525 0.7 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.002 -178.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.9 m -111.12 -22.97 11.17 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 173.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.7 mt -69.13 146.44 52.51 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 120.898 0.38 . . . . 0.0 111.373 -176.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.3 tt0 -115.78 135.93 53.54 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.662 175.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.1 mt -112.03 158.58 19.38 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.07 0.462 . . . . 0.0 111.058 -176.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -147.87 140.22 24.4 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.957 -0.756 . . . . 0.0 108.957 177.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 32.1 t -106.94 109.34 21.21 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.386 -177.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -106.83 103.68 48.25 Favored Pre-proline 0 C--N 1.329 -0.299 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 169.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.1 145.25 78.48 Favored 'Trans proline' 0 N--CA 1.498 1.779 0 CA-C-N 120.391 1.175 . . . . 0.0 112.037 -170.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -92.61 17.53 41.6 Favored 'Cis proline' 0 N--CA 1.499 1.84 0 CA-C-N 120.893 1.355 . . . . 0.0 113.346 -3.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -104.89 162.11 13.61 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 110.337 -0.246 . . . . 0.0 110.337 -177.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 32.8 tp -115.72 133.48 55.99 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 122.062 -0.399 . . . . 0.0 111.177 -179.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.47 HD11 ' CG2' ' A' ' 102' ' ' ILE . 9.5 tp -122.53 140.42 52.79 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.252 -175.086 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -142.89 154.96 44.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.768 0.318 . . . . 0.0 110.492 176.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.8 mtm105 -101.96 146.65 27.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.71 -178.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -127.14 163.4 23.9 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.668 0.746 . . . . 0.0 111.414 -177.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 31.6 mp0 -48.33 147.17 2.44 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.112 -177.062 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 64.31 30.96 13.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.118 -0.946 . . . . 0.0 112.176 179.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 48.9 m 67.29 35.24 4.48 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.901 0.381 . . . . 0.0 111.631 165.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -99.82 151.36 21.37 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 178.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.575 HD13 ' CH2' ' B' 1345 ' ' TRP . 76.4 mt -114.71 126.51 72.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -178.504 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -137.21 149.72 47.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.13 179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -147.39 169.42 28.34 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.001 -175.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -125.16 136.81 53.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.364 -0.418 . . . . 0.0 110.415 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 46.2 t90 -104.47 125.17 50.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.509 176.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.469 ' CD2' HG22 ' A' ' 31' ' ' VAL . 77.4 m-85 -112.22 140.91 46.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.733 -177.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -51.49 -40.78 60.21 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.81 179.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -129.06 136.55 50.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.671 0.272 . . . . 0.0 110.462 -179.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 85.2 p -63.14 -41.52 99.3 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.309 -177.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -60.38 -44.81 95.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.514 0.673 . . . . 0.0 109.985 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -55.98 -43.48 77.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.206 178.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 51.6 t -59.35 -41.46 89.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.527 177.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -58.65 -44.59 90.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.618 -176.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -60.56 -49.33 77.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.748 -177.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.614 HG23 HD11 ' A' ' 54' ' ' ILE . 30.4 mm -58.29 -45.91 89.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.099 0.476 . . . . 0.0 110.077 -178.109 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 78.0 p -59.99 -43.5 95.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.702 -177.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.66 -43.27 94.44 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.68 -0.968 . . . . 0.0 110.68 -178.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.494 HD13 ' HB2' ' A' ' 26' ' ' ASP . 10.6 mt -59.83 -49.8 76.3 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.017 0.436 . . . . 0.0 110.686 -178.036 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 59.0 t -59.01 -42.67 86.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.148 -178.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -58.45 -43.03 88.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.861 0.362 . . . . 0.0 110.639 -178.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.25 -40.58 98.78 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.335 -0.706 . . . . 0.0 111.335 -179.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 34.8 mt -63.08 -42.97 99.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.794 0.33 . . . . 0.0 111.077 178.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 40.5 mt -63.17 -44.85 94.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.435 -177.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 12.6 pttp -73.07 -34.44 66.24 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.831 -0.348 . . . . 0.0 111.743 -176.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 28.6 t -93.94 145.6 24.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.881 0.372 . . . . 0.0 110.698 -178.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 57.4 tttp . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.498 179.858 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.411 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -50.71 141.92 33.54 Favored 'Trans proline' 0 N--CA 1.495 1.573 0 C-N-CA 121.328 1.352 . . . . 0.0 112.032 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -121.94 147.26 46.25 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.396 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -67.63 157.74 85.1 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.424 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -71.16 -50.01 0.34 Allowed 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 121.257 1.304 . . . . 0.0 112.273 -178.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 94.6 mt -141.26 -68.53 0.39 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.669 -179.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.3 mt -98.45 152.42 19.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.728 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -134.67 148.59 50.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.499 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 98.1 mm-40 -93.59 -65.64 0.98 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.638 -179.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -135.64 157.36 47.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.594 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 49.9 ttt180 -98.57 132.11 44.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.439 179.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -95.3 154.11 39.5 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.666 -179.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -80.91 161.96 20.97 Favored 'Trans proline' 0 N--CA 1.492 1.422 0 C-N-CA 121.517 1.478 . . . . 0.0 111.961 179.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 27.6 p90 -131.23 155.97 80.78 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.496 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -57.77 128.88 30.82 Favored 'Trans proline' 0 N--CA 1.495 1.561 0 C-N-CA 121.136 1.224 . . . . 0.0 111.587 -179.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 102.2 -4.99 52.23 Favored Glycine 0 CA--C 1.534 1.269 0 CA-C-O 119.646 -0.53 . . . . 0.0 113.439 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -56.89 134.5 55.49 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 118.279 1.039 . . . . 0.0 110.437 177.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 6.0 ttt -75.39 135.03 72.78 Favored Pre-proline 0 CA--C 1.535 0.402 0 CA-C-O 118.699 -0.667 . . . . 0.0 110.326 -177.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -65.95 153.49 77.89 Favored 'Trans proline' 0 N--CA 1.496 1.669 0 C-N-CA 121.183 1.256 . . . . 0.0 111.684 175.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -104.96 110.25 22.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.426 178.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1338 ' ' LEU . . . . . 0.458 HD12 ' CB ' ' A' ' 43' ' ' TRP . 13.9 mt -71.65 151.73 93.58 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.023 -179.64 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -79.14 139.9 15.32 Favored 'Trans proline' 0 N--CA 1.491 1.361 0 C-N-CA 121.182 1.255 . . . . 0.0 111.221 174.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -97.06 125.77 44.78 Favored Pre-proline 0 CA--C 1.534 0.363 0 CA-C-O 118.721 -0.657 . . . . 0.0 109.997 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -72.57 155.43 54.76 Favored 'Trans proline' 0 N--CA 1.496 1.664 0 C-N-CA 121.383 1.389 . . . . 0.0 111.681 173.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.05 157.0 6.63 Favored 'Trans proline' 0 N--CA 1.495 1.57 0 C-N-CA 121.31 1.34 . . . . 0.0 111.613 178.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.3 tp -49.9 -29.94 9.18 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -177.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 56.8 t80 -55.15 -37.7 67.3 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.833 0.349 . . . . 0.0 111.207 -177.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1345 ' ' TRP . . . . . 0.575 ' CH2' HD13 ' A' ' 102' ' ' ILE . 20.3 t90 -61.11 -48.14 83.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.256 -177.059 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -62.02 -47.83 83.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.007 0.432 . . . . 0.0 110.531 -177.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -59.33 -44.59 92.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.838 -177.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -58.99 -46.59 87.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.699 -176.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.09 -47.88 84.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.721 -177.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -59.02 -42.74 90.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.006 -176.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 63.0 tttm -64.29 -47.17 80.49 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.096 -177.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -54.93 -47.36 74.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.075 -178.374 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 42.4 tp10 -64.91 -36.98 86.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.114 178.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -63.34 150.42 43.44 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.824 0.345 . . . . 0.0 110.56 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 25.9 tp . . . . . 0 C--O 1.22 -0.494 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.552 -179.967 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.358 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -65.28 139.95 62.25 Favored 'Trans proline' 0 N--CA 1.497 1.683 0 CA-C-N 119.319 1.56 . . . . 0.0 111.961 -175.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.0 m80 -56.95 -40.94 77.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.759 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 85.5 mtp -89.62 158.08 17.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.681 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -140.75 156.46 46.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.564 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 76.0 m-20 -61.55 166.88 3.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.611 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 29.1 tp -55.95 -40.2 72.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.81 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.0 mmm -84.6 124.66 31.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.273 179.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -97.79 135.69 39.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.7 -179.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -102.42 167.6 9.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.363 179.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.5 mp0 -64.34 -40.56 96.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.73 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 87.0 p -58.26 -42.52 86.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.937 0.398 . . . . 0.0 110.377 -178.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mm -60.19 -45.2 96.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.215 -178.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.8 m -59.3 -44.45 92.52 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.525 -177.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -59.31 -45.99 89.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.542 -178.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.5 mtt -58.21 -44.18 88.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.126 0.489 . . . . 0.0 110.428 -178.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -60.09 -48.24 82.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.292 -178.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.664 ' HA ' HD12 ' A' ' 14' ' ' ILE . 9.8 tp -60.83 -32.35 71.74 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.193 -178.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.7 -50.2 72.09 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.668 0.27 . . . . 0.0 110.636 178.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.55 -41.91 86.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.031 0.443 . . . . 0.0 110.418 179.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.699 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 97.7 mt -54.17 -52.96 32.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.654 178.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -53.35 -23.42 9.37 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -178.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -59.53 -33.83 71.88 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -177.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.7 mm -108.5 -42.43 5.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.823 0.344 . . . . 0.0 110.173 -177.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -117.09 77.85 9.46 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.18 -177.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -55.04 -21.07 25.63 Favored 'Trans proline' 0 N--CA 1.498 1.753 0 C-N-CA 121.516 1.477 . . . . 0.0 113.529 -175.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.1 p90 -90.87 9.96 28.21 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.574 0.954 . . . . 0.0 113.574 -174.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.53 127.87 33.66 Favored 'General case' 0 C--O 1.231 0.123 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 175.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 69.1 tttt -97.46 -40.47 8.66 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.651 -176.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -157.93 155.81 30.18 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.679 -0.408 . . . . 0.0 111.38 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 37.0 mt -89.79 140.16 16.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.951 177.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.6 t -92.74 -47.13 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.83 176.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.496 ' HB2' HD13 ' A' ' 119' ' ' LEU . 6.0 t0 -156.49 158.97 38.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.884 178.466 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.5 p -143.24 134.58 26.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.162 0.506 . . . . 0.0 111.323 -179.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 24.1 t -109.58 124.69 51.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.598 176.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.0 t -54.36 -38.88 66.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.302 -172.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -149.11 125.85 11.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.205 0.526 . . . . 0.0 111.81 -178.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.454 HG21 ' HB3' ' A' ' 52' ' ' PHE . 87.3 t -145.18 139.28 22.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 114.986 -1.006 . . . . 0.0 109.506 -177.524 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.04 149.83 50.7 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.041 -178.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.607 ' CD2' HG21 ' A' ' 46' ' ' THR . 12.8 t80 -96.61 133.44 41.11 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.379 0.609 . . . . 0.0 111.884 -176.262 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -127.79 139.87 52.4 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.222 177.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 93.8 m -122.73 146.15 47.76 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -108.22 130.6 55.14 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.862 0.363 . . . . 0.0 110.317 176.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 29.9 t-20 -101.54 116.24 32.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.998 -0.547 . . . . 0.0 109.983 177.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.8 m -68.13 -33.05 73.77 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.902 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.0 p -62.23 -37.02 83.8 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.178 -177.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -95.56 -21.41 18.28 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -178.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 69.0 45.29 0.93 Allowed 'General case' 0 C--O 1.231 0.108 0 CA-C-O 121.424 0.631 . . . . 0.0 109.489 -177.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 32.0 tp10 -156.05 152.37 27.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.013 -177.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.45 ' CB ' HD12 ' B' 1338 ' ' LEU . 85.2 m95 -86.78 143.67 27.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.296 176.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.7 tp10 -125.0 129.42 50.29 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 176.14 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 20.4 pttp -75.11 138.86 42.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.127 177.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.607 HG21 ' CD2' ' A' ' 33' ' ' PHE . 68.5 p -92.4 167.57 11.89 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.16 -178.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -82.94 12.29 5.11 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 178.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.1 t -101.29 106.53 19.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-O 120.962 0.41 . . . . 0.0 110.289 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -130.7 113.87 14.69 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 176.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.67 176.57 38.97 Favored Glycine 0 CA--C 1.52 0.391 0 C-N-CA 120.221 -0.99 . . . . 0.0 112.322 -169.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.465 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -80.91 134.93 35.82 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 175.341 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.454 ' HB3' HG21 ' A' ' 31' ' ' VAL . 7.9 t80 -98.51 129.64 45.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.849 0.356 . . . . 0.0 110.201 -176.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.465 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.7 m-85 -132.96 143.53 49.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.237 177.516 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.668 HD11 HG23 ' A' ' 116' ' ' ILE . 69.0 mt -101.58 128.65 53.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 172.328 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.699 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 12.3 m-30 -108.58 135.78 49.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.843 0.354 . . . . 0.0 111.183 -175.473 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 50.1 t60 -118.34 143.26 46.75 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.238 176.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 60.0 ttt180 -141.97 147.92 37.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.147 178.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -86.83 28.07 0.93 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 178.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -159.1 167.36 29.4 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 80.2 mt-10 -63.94 128.47 92.99 Favored Pre-proline 0 CA--C 1.538 0.509 0 CA-C-O 118.436 -0.793 . . . . 0.0 110.002 -178.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -74.94 140.93 70.08 Favored 'Cis proline' 0 N--CA 1.497 1.722 0 CA-C-N 121.943 1.729 . . . . 0.0 111.753 -1.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -65.45 -47.06 77.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.085 -177.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -142.69 137.37 29.83 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.431 0.634 . . . . 0.0 110.936 -176.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.0 t -151.14 152.28 33.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.45 -177.244 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.414 HG13 HD11 ' A' ' 80' ' ' ILE . 41.8 mt -107.04 141.61 21.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -131.74 141.93 49.65 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.371 -177.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.3 mt -128.38 131.42 69.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.25 0.548 . . . . 0.0 110.237 174.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -98.76 99.47 10.57 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 114.957 -1.019 . . . . 0.0 109.626 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -73.74 105.88 5.23 Favored 'General case' 0 N--CA 1.463 0.188 0 O-C-N 123.679 0.612 . . . . 0.0 110.717 -176.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 -73.64 -41.3 62.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.587 -170.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 66.5 mt -72.17 -45.21 61.36 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.551 -174.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 57.5 m-20 -95.07 -3.32 48.41 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.702 1.001 . . . . 0.0 113.702 -175.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.416 HG22 ' O ' ' A' ' 73' ' ' THR . 10.9 m 54.72 43.53 29.97 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 121.516 0.674 . . . . 0.0 110.748 176.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 32.6 m -126.99 145.21 50.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.511 -178.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 13.6 p -90.75 130.91 36.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.25 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -119.41 122.32 41.5 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 175.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 34.6 t -125.4 145.14 33.26 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-O 120.614 0.245 . . . . 0.0 110.623 -177.202 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -148.68 126.39 5.73 Favored Pre-proline 0 CA--C 1.538 0.501 0 CA-C-O 118.747 -0.644 . . . . 0.0 110.498 174.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -75.27 150.91 37.69 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 121.621 1.547 . . . . 0.0 111.891 175.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.414 HD11 HG13 ' A' ' 65' ' ' ILE . 66.4 mt -93.68 120.35 42.94 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.156 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.416 179.071 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 68.3 p -99.33 154.25 18.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.785 175.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -93.7 26.49 16.01 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.721 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.5 t -111.04 -12.86 14.16 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.411 0.522 . . . . 0.0 112.411 174.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 78.0 mt -67.52 146.14 54.23 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.072 0.463 . . . . 0.0 111.262 -176.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.1 tt0 -117.62 135.85 53.7 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.801 176.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 63.0 mt -112.18 155.56 23.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.923 0.392 . . . . 0.0 110.8 -177.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -147.55 144.16 28.31 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 179.079 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.0 t -99.48 109.09 21.68 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.668 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -106.77 103.78 48.5 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 171.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -71.18 143.52 44.31 Favored 'Trans proline' 0 N--CA 1.496 1.671 0 CA-C-N 120.527 1.224 . . . . 0.0 112.329 -169.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -90.4 14.93 48.91 Favored 'Cis proline' 0 N--CA 1.499 1.842 0 CA-C-N 121.05 1.411 . . . . 0.0 113.481 -4.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -95.46 170.67 9.2 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 122.419 0.288 . . . . 0.0 110.776 -177.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 52.4 tp -116.32 133.47 55.99 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 174.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.441 HD11 ' CG2' ' A' ' 102' ' ' ILE . 11.1 tp -125.09 140.51 52.82 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.392 -173.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 48.0 p90 -142.97 150.08 39.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.943 0.402 . . . . 0.0 110.523 175.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 26.5 mtm180 -102.37 146.9 27.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.26 -175.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -128.46 157.17 41.85 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.901 0.857 . . . . 0.0 111.367 -179.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 54.6 tt0 -49.57 150.05 2.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.724 -177.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 64.56 30.95 12.62 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.241 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 42.1 t 68.88 35.27 2.97 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.005 0.431 . . . . 0.0 111.645 164.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -98.96 140.61 32.85 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 177.531 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.441 ' CG2' HD11 ' A' ' 94' ' ' LEU . 78.9 mt -114.75 124.05 71.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 -177.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -135.14 146.1 48.45 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.423 -178.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -144.33 169.35 26.4 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 120.888 -0.673 . . . . 0.0 111.648 -177.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -126.16 142.81 51.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.027 0.441 . . . . 0.0 110.752 179.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 73.7 t90 -106.31 125.01 50.47 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.443 174.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.437 ' CD1' HG22 ' A' ' 31' ' ' VAL . 64.5 m-85 -111.29 139.69 46.48 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 123.281 0.363 . . . . 0.0 110.611 -179.138 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -51.74 -37.53 51.46 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.678 179.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -132.54 136.06 46.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.42 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 84.5 p -62.8 -41.62 99.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.303 -177.507 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -59.85 -44.02 94.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.509 0.671 . . . . 0.0 110.016 178.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -56.51 -44.67 80.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.067 178.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 50.2 t -59.2 -39.72 83.49 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.519 177.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -58.89 -45.94 89.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.852 0.358 . . . . 0.0 110.642 -177.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 22.8 ttp-105 -61.33 -50.16 74.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.791 -177.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.668 HG23 HD11 ' A' ' 54' ' ' ILE . 30.2 mm -58.56 -44.16 88.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.051 0.453 . . . . 0.0 110.0 -178.19 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 59.7 p -59.85 -43.99 94.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.698 -177.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.56 -43.75 94.08 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 110.649 -0.98 . . . . 0.0 110.649 -178.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.496 HD13 ' HB2' ' A' ' 26' ' ' ASP . 12.0 mt -58.97 -48.5 81.31 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.05 0.453 . . . . 0.0 110.598 -178.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 54.5 t -59.07 -44.3 91.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.067 -178.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -57.39 -42.14 81.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.63 -178.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -61.9 -45.25 96.56 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -179.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 62.1 mt -58.65 -42.19 87.81 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.926 0.393 . . . . 0.0 110.642 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 88.0 mt -58.89 -40.46 84.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.867 -178.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 26.7 pttt -90.78 -8.13 50.53 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -179.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 29.9 t -113.99 142.72 45.81 Favored 'General case' 0 C--O 1.231 0.115 0 O-C-N 122.144 -0.348 . . . . 0.0 110.496 -179.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 97.5 mttt . . . . . 0 C--O 1.221 -0.423 0 CA-C-O 117.893 -1.051 . . . . 0.0 110.556 179.946 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.323 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -68.64 144.21 59.34 Favored 'Trans proline' 0 N--CA 1.495 1.565 0 C-N-CA 121.356 1.371 . . . . 0.0 111.892 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -97.89 122.28 40.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.533 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -72.93 153.78 90.98 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.492 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -52.08 150.93 17.69 Favored 'Trans proline' 0 N--CA 1.495 1.582 0 C-N-CA 121.272 1.315 . . . . 0.0 111.951 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 78.2 mt -68.11 -45.33 73.99 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.061 -178.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 25.7 tp -138.14 131.47 30.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.774 0.321 . . . . 0.0 110.906 -178.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -135.98 128.54 30.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.523 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -98.99 -67.13 0.86 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.582 179.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -138.3 146.97 43.08 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.498 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 61.1 ttm-85 -102.46 119.23 38.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.512 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1329 ' ' ALA . . . . . 0.434 ' HB1' ' HD2' ' B' 1330 ' ' PRO . . . -108.56 161.53 23.21 Favored Pre-proline 0 CA--C 1.531 0.235 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.517 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 1330 ' ' PRO . . . . . 0.434 ' HD2' ' HB1' ' B' 1329 ' ' ALA . 34.1 Cg_endo -65.31 143.47 77.05 Favored 'Trans proline' 0 N--CA 1.496 1.619 0 C-N-CA 121.243 1.295 . . . . 0.0 111.793 179.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -113.9 99.85 51.12 Favored Pre-proline 0 CA--C 1.533 0.289 0 CA-C-O 119.216 -0.421 . . . . 0.0 110.516 -179.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -57.9 128.98 31.06 Favored 'Trans proline' 0 N--CA 1.496 1.623 0 C-N-CA 121.112 1.208 . . . . 0.0 111.538 177.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 101.14 -5.06 55.7 Favored Glycine 0 CA--C 1.534 1.263 0 C-N-CA 121.263 -0.494 . . . . 0.0 113.374 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -54.44 145.89 17.27 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 118.278 1.039 . . . . 0.0 110.914 178.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 11.3 ttp -61.27 143.66 92.47 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.158 -178.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -63.4 154.01 70.96 Favored 'Trans proline' 0 N--CA 1.496 1.659 0 C-N-CA 121.241 1.294 . . . . 0.0 111.522 175.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 37.0 t30 -99.21 99.88 10.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.451 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1338 ' ' LEU . . . . . 0.45 HD12 ' CB ' ' A' ' 43' ' ' TRP . 19.9 mt -67.35 134.96 93.18 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 118.493 -0.765 . . . . 0.0 109.613 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -79.15 139.63 15.13 Favored 'Trans proline' 0 N--CA 1.493 1.455 0 CA-C-N 120.394 1.176 . . . . 0.0 111.193 174.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 6.7 mtmp? -97.28 125.99 43.51 Favored Pre-proline 0 CA--C 1.535 0.403 0 CA-C-O 118.343 -0.837 . . . . 0.0 110.119 178.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -61.86 165.34 14.3 Favored 'Trans proline' 0 N--CA 1.497 1.722 0 CA-C-N 120.657 1.27 . . . . 0.0 111.655 177.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -49.27 156.98 2.2 Favored 'Trans proline' 0 N--CA 1.497 1.679 0 C-N-CA 121.395 1.397 . . . . 0.0 111.866 178.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1343 ' ' LEU . . . . . 0.515 ' H ' HD12 ' B' 1343 ' ' LEU . 6.2 mp -50.17 -29.19 8.74 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -176.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -56.4 -35.79 68.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.733 0.301 . . . . 0.0 111.429 -176.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1345 ' ' TRP . . . . . . . . . . . . . 54.9 t90 -60.77 -48.14 83.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.955 0.407 . . . . 0.0 110.465 -176.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -65.23 -48.11 74.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.921 0.391 . . . . 0.0 110.804 -178.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -57.81 -44.39 86.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.964 0.412 . . . . 0.0 110.758 -176.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -59.19 -47.9 83.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.398 -177.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -57.82 -45.27 86.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.684 -177.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1350 ' ' GLN . . . . . 0.54 ' O ' ' HB3' ' B' 1354 ' ' ALA . 52.1 mt-30 -61.23 -46.14 91.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.319 -176.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 60.7 tttm -61.84 -47.71 83.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.138 -175.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 -64.29 -48.97 73.65 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.804 -176.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -90.94 15.12 12.03 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 -176.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1354 ' ' ALA . . . . . 0.54 ' HB3' ' O ' ' B' 1350 ' ' GLN . . . -143.03 150.9 40.21 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-O 120.874 0.369 . . . . 0.0 110.678 178.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 27.8 tp . . . . . 0 C--O 1.221 -0.421 0 CA-C-O 118.07 -0.967 . . . . 0.0 110.57 -179.863 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.306 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -69.54 130.11 19.03 Favored 'Trans proline' 0 N--CA 1.496 1.633 0 CA-C-N 118.841 1.32 . . . . 0.0 112.01 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -110.67 -40.44 4.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.766 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 95.3 mmm -56.41 -38.1 71.08 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.919 -179.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -56.7 139.91 48.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.76 0.314 . . . . 0.0 110.704 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -84.62 125.86 32.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.612 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . 0.513 ' H ' HD12 ' A' ' 0' ' ' LEU . 6.3 mp -57.74 -40.53 79.87 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.714 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.2 mtt -92.5 133.23 36.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.473 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.53 137.42 50.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.634 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 77.1 m-20 -74.34 157.67 35.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.61 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -60.1 -37.07 78.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.004 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.2 p -57.46 -41.54 80.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.976 0.417 . . . . 0.0 110.427 -179.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.2 mm -60.18 -44.44 95.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.198 -179.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.4 m -59.05 -44.71 91.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.991 0.424 . . . . 0.0 110.534 -177.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -59.36 -47.12 86.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.4 -178.472 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 87.2 mtp -58.29 -42.49 86.71 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.127 0.489 . . . . 0.0 110.41 -178.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -59.88 -48.5 81.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.298 -178.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.671 ' HA ' HD12 ' A' ' 14' ' ' ILE . 8.7 tp -60.4 -33.43 72.47 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.127 -178.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.5 -50.03 73.03 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.65 0.262 . . . . 0.0 110.688 179.041 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.11 -41.18 87.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.952 0.406 . . . . 0.0 110.565 179.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.703 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 96.8 mt -54.19 -52.88 33.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.618 178.507 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -53.61 -24.06 12.86 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -177.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.7 mtpt -60.25 -33.07 71.79 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -177.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 45.8 mm -109.12 -41.25 4.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.802 0.334 . . . . 0.0 110.407 -176.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -116.27 77.82 7.66 Favored Pre-proline 0 CA--C 1.535 0.392 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.311 -177.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -53.72 -20.46 17.06 Favored 'Trans proline' 0 N--CA 1.498 1.784 0 C-N-CA 121.469 1.446 . . . . 0.0 113.427 -176.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.2 p90 -94.42 17.63 12.66 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -174.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -92.45 127.5 37.96 Favored 'General case' 0 C--O 1.232 0.133 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 173.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.463 ' O ' HD21 ' A' ' 11' ' ' LEU . 79.2 tttt -101.57 -40.61 6.94 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.75 -176.338 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -150.59 156.37 41.25 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.976 0.417 . . . . 0.0 111.336 -179.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 58.1 mt -93.09 136.5 24.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.174 177.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 46.1 t -88.44 -47.1 15.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.753 176.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.495 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -152.34 157.01 40.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.865 177.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.4 p -143.29 131.98 22.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.988 0.423 . . . . 0.0 111.056 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.6 t -109.13 126.17 52.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.706 177.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.2 t -54.47 -39.08 67.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.243 -171.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -150.21 127.04 11.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.242 0.544 . . . . 0.0 111.722 -178.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.472 HG21 ' HB3' ' A' ' 52' ' ' PHE . 94.6 t -145.14 140.5 22.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.437 -177.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.46 149.81 51.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.14 -177.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -97.91 132.08 43.81 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.249 0.547 . . . . 0.0 111.588 -176.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -125.61 142.31 51.57 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.759 179.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 80.4 m -120.81 148.14 44.41 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.184 -0.672 . . . . 0.0 109.184 177.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -109.48 131.97 54.56 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.975 0.417 . . . . 0.0 110.483 176.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -104.25 116.15 31.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.969 177.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 85.1 p -69.85 -31.03 68.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.137 -176.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -61.9 -38.1 87.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.662 0.267 . . . . 0.0 110.914 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -95.49 -21.42 18.32 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -178.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 28.3 t30 69.16 43.67 1.07 Allowed 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.366 0.603 . . . . 0.0 109.739 -177.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -151.07 164.52 36.27 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.99 -177.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 85.0 m95 -96.01 141.55 29.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.468 178.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -123.88 127.46 48.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.945 177.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.9 ttpp -75.1 139.96 43.12 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 62.3 p -92.34 173.35 7.85 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.088 -179.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -84.83 12.6 7.07 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 178.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.7 t -104.28 106.48 20.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 121.0 0.428 . . . . 0.0 110.311 179.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -130.47 115.03 16.26 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 176.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.63 176.51 38.95 Favored Glycine 0 CA--C 1.52 0.367 0 C-N-CA 120.08 -1.057 . . . . 0.0 112.182 -169.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.454 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -81.36 136.51 35.74 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 175.474 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.472 ' HB3' HG21 ' A' ' 31' ' ' VAL . 8.9 t80 -99.15 129.91 45.43 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.085 -176.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.454 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 9.1 m-85 -133.46 143.13 48.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.287 177.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.678 HD11 HG23 ' A' ' 116' ' ' ILE . 69.9 mt -101.65 128.14 54.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 172.324 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.703 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 13.7 m-30 -108.42 134.39 51.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.836 0.351 . . . . 0.0 111.136 -174.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 59.6 t60 -119.68 140.09 51.2 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.19 176.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.3 tpt180 -142.15 149.84 40.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.709 177.056 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -86.85 28.12 0.93 Allowed 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.79 170.19 22.93 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -64.13 125.98 89.26 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-O 118.46 -0.781 . . . . 0.0 110.005 -178.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.65 140.93 65.37 Favored 'Cis proline' 0 N--CA 1.497 1.682 0 CA-C-N 121.844 1.694 . . . . 0.0 111.833 -1.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -65.7 -47.71 74.46 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.059 -177.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 77.7 m80 -142.15 135.38 28.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.458 0.647 . . . . 0.0 110.926 -176.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.0 t -150.93 152.36 33.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.413 -177.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.2 mt -107.93 140.13 27.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -131.73 142.0 49.67 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.625 -177.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.0 mt -127.89 130.9 70.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 121.238 0.542 . . . . 0.0 110.053 173.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -99.21 99.61 10.61 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.753 -179.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -71.69 105.07 3.56 Favored 'General case' 0 C--N 1.332 -0.183 0 O-C-N 123.757 0.661 . . . . 0.0 110.672 -177.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -72.52 -42.05 65.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.5 -170.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.8 mt -71.95 -45.27 61.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.702 -174.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 54.7 m-20 -95.02 -3.35 48.52 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -175.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.9 m 54.94 43.6 29.65 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.399 0.619 . . . . 0.0 110.648 177.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.7 m -125.35 141.59 51.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.531 -178.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 14.8 p -88.15 130.18 35.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.291 -179.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -118.85 122.29 42.0 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 175.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 30.3 t -125.5 145.75 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.3 0 CA-C-O 120.678 0.275 . . . . 0.0 110.532 -177.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -149.14 126.36 5.52 Favored Pre-proline 0 CA--C 1.538 0.488 0 CA-C-O 118.698 -0.667 . . . . 0.0 110.561 174.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -75.41 150.95 37.12 Favored 'Trans proline' 0 N--CA 1.498 1.757 0 C-N-CA 121.463 1.442 . . . . 0.0 112.305 177.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 69.2 mt -92.65 133.93 32.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 CA-C-O 120.977 0.418 . . . . 0.0 110.249 178.122 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.0 p -132.14 158.48 41.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.775 177.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -94.68 35.03 4.4 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.026 -178.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.7 t -108.47 -23.31 11.92 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 173.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.5 mt -68.36 148.58 50.5 Favored 'General case' 0 C--O 1.23 0.077 0 CA-C-O 120.922 0.391 . . . . 0.0 111.324 -176.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.5 tt0 -118.16 135.84 53.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.784 176.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 69.4 mt -113.9 157.93 21.74 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.075 0.464 . . . . 0.0 111.0 -176.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -148.14 139.54 23.56 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 30.2 t -97.33 109.17 21.98 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.793 -179.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -106.71 103.74 48.16 Favored Pre-proline 0 C--N 1.329 -0.321 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 172.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -71.18 139.61 35.74 Favored 'Trans proline' 0 N--CA 1.496 1.676 0 CA-C-N 120.619 1.257 . . . . 0.0 112.002 -171.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -89.11 9.0 65.74 Favored 'Cis proline' 0 N--CA 1.501 1.943 0 CA-C-N 121.213 1.469 . . . . 0.0 113.764 -4.282 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -84.62 170.11 13.69 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.7 0.286 . . . . 0.0 111.223 -177.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 53.7 tp -118.66 131.75 56.17 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 170.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.449 HD11 ' CG2' ' A' ' 102' ' ' ILE . 11.6 tp -123.63 139.56 53.87 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 110.408 -0.219 . . . . 0.0 110.408 -174.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 11.7 p90 -144.49 151.3 38.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.938 0.399 . . . . 0.0 110.651 176.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 29.4 mtm180 -102.13 148.93 24.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.023 -176.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -130.91 165.65 22.63 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.841 0.829 . . . . 0.0 111.666 -178.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -48.39 148.17 2.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.436 -0.802 . . . . 0.0 112.092 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 71.9 mtt85 63.17 30.86 15.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.212 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 52.1 m 66.55 35.18 5.57 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.921 0.391 . . . . 0.0 111.598 166.108 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -98.16 149.45 22.52 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 178.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.616 HD13 ' CH2' ' B' 1345 ' ' TRP . 82.4 mt -117.89 127.84 75.1 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 121.064 0.459 . . . . 0.0 109.824 -177.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -135.99 150.38 49.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.382 177.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -142.25 169.36 25.43 Favored Glycine 0 CA--C 1.522 0.53 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 -176.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 60.6 m-85 -125.38 139.45 53.66 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.847 0.356 . . . . 0.0 110.622 -179.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 7.4 t90 -107.75 127.55 53.78 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.57 175.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.451 ' CD2' HG22 ' A' ' 31' ' ' VAL . 71.4 m-85 -116.14 144.2 44.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.832 0.349 . . . . 0.0 110.682 -179.743 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -51.57 -37.49 49.98 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.626 178.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -134.06 135.92 43.64 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.846 0.355 . . . . 0.0 110.531 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.8 m -61.33 -42.01 97.98 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.098 -177.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -59.46 -43.5 93.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.401 0.62 . . . . 0.0 110.081 178.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -56.31 -44.84 80.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.084 178.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 42.9 t -59.94 -39.85 86.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.708 178.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -59.28 -45.31 91.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.771 0.319 . . . . 0.0 110.608 -177.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -60.08 -49.13 78.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.518 -177.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.678 HG23 HD11 ' A' ' 54' ' ' ILE . 35.3 mm -58.43 -45.49 89.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.047 0.451 . . . . 0.0 110.094 -178.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 68.3 p -59.72 -43.34 94.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.756 -177.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.74 -44.36 94.17 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 110.66 -0.976 . . . . 0.0 110.66 -179.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.495 HD13 ' HB2' ' A' ' 26' ' ' ASP . 10.8 mt -58.77 -48.29 81.74 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.081 0.467 . . . . 0.0 110.503 -178.403 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 52.0 t -58.91 -43.78 89.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.171 -178.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -57.46 -42.41 82.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.635 -178.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -62.32 -43.16 99.47 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 78.2 mt -61.79 -41.37 97.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.833 0.349 . . . . 0.0 111.044 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 27.6 mt -65.87 -44.82 84.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.682 -177.263 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 26.7 pttt -72.7 -35.35 67.59 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.77 -175.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 29.1 t -106.11 134.98 48.38 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.837 0.351 . . . . 0.0 110.743 -178.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt . . . . . 0 C--O 1.221 -0.442 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.538 179.85 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.316 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -50.04 137.0 37.22 Favored 'Trans proline' 0 N--CA 1.495 1.587 0 CA-C-N 118.85 1.325 . . . . 0.0 112.088 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -104.6 126.15 51.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.518 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -71.02 154.54 94.13 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.538 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -49.02 108.98 0.22 Allowed 'Trans proline' 0 N--CA 1.495 1.603 0 C-N-CA 121.31 1.34 . . . . 0.0 112.034 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 29.3 tp -62.89 -39.3 94.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.944 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1324 ' ' LEU . . . . . 0.491 ' N ' HD12 ' B' 1324 ' ' LEU . 6.8 mp -85.18 123.45 30.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.909 0.385 . . . . 0.0 110.642 -179.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -143.5 157.68 44.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.455 179.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.87 -40.92 85.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.676 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -136.32 129.08 30.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.389 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 83.0 mtm180 -74.65 123.38 24.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.566 -179.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -108.61 155.24 40.89 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.554 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -77.5 153.76 30.9 Favored 'Trans proline' 0 N--CA 1.492 1.394 0 C-N-CA 121.464 1.443 . . . . 0.0 111.994 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -55.38 -61.64 5.74 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.191 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -63.66 128.93 23.46 Favored 'Trans proline' 0 N--CA 1.495 1.606 0 C-N-CA 120.935 1.09 . . . . 0.0 111.661 -176.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 96.25 -4.97 65.17 Favored Glycine 0 CA--C 1.535 1.294 0 C-N-CA 121.146 -0.549 . . . . 0.0 113.404 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -56.37 132.59 51.47 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-N 118.209 1.005 . . . . 0.0 110.618 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 6.4 ttt -92.94 140.46 23.47 Favored Pre-proline 0 CA--C 1.534 0.349 0 CA-C-O 118.907 -0.568 . . . . 0.0 109.974 -179.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -74.62 147.04 35.16 Favored 'Trans proline' 0 N--CA 1.495 1.577 0 C-N-CA 121.219 1.279 . . . . 0.0 111.652 176.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 5.3 p30 -96.88 104.42 16.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.826 -178.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 10.8 mt -65.96 150.37 96.63 Favored Pre-proline 0 C--N 1.33 -0.275 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 177.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -79.14 139.73 15.2 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 C-N-CA 121.101 1.201 . . . . 0.0 111.241 175.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -97.3 125.96 43.59 Favored Pre-proline 0 CA--C 1.537 0.448 0 CA-C-O 118.474 -0.774 . . . . 0.0 109.915 178.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -78.17 169.05 20.91 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 121.272 1.315 . . . . 0.0 111.792 176.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -62.0 156.59 48.56 Favored 'Trans proline' 0 N--CA 1.495 1.616 0 C-N-CA 121.261 1.308 . . . . 0.0 111.41 177.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.9 tp -50.04 -28.55 7.22 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.451 0.538 . . . . 0.0 112.451 -176.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 67.9 t80 -54.84 -37.31 66.02 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.773 0.32 . . . . 0.0 111.304 -176.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1345 ' ' TRP . . . . . 0.616 ' CH2' HD13 ' A' ' 102' ' ' ILE . 46.1 t90 -61.61 -48.07 82.57 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.411 -176.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -61.88 -48.98 78.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.025 0.441 . . . . 0.0 110.41 -177.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -58.92 -45.13 91.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.879 -176.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -59.28 -47.03 86.89 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.651 -176.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -60.23 -47.21 86.95 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.779 -177.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -61.1 -47.2 87.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.522 -173.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 31.1 pttt -70.94 -41.27 71.37 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.884 -175.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -60.52 -47.73 84.88 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 121.057 -0.257 . . . . 0.0 111.245 -178.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 42.3 tp10 -65.0 -37.05 86.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.214 -179.265 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -153.25 151.57 30.2 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.911 0.386 . . . . 0.0 110.593 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 27.6 tp . . . . . 0 C--O 1.22 -0.464 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.518 179.853 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.345 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -67.98 139.46 47.15 Favored 'Trans proline' 0 N--CA 1.496 1.627 0 C-N-CA 121.325 1.35 . . . . 0.0 111.945 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -56.87 -40.57 76.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.798 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 65.6 mtt -98.01 166.91 11.21 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.633 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -139.76 166.81 23.63 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.538 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -57.53 145.75 32.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.548 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 29.4 tp -56.94 -40.83 77.16 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.692 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.7 mtt -99.03 129.96 45.33 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.515 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -178.09 102.91 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.58 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.9 p-10 -125.81 73.97 1.38 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.365 0.602 . . . . 0.0 110.593 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -67.32 -36.42 81.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.318 -178.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 85.8 p -57.37 -42.03 81.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.988 0.423 . . . . 0.0 110.558 -177.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.9 mm -60.43 -44.47 96.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.193 -178.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 35.2 m -59.41 -45.54 91.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.931 0.396 . . . . 0.0 110.499 -177.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -59.77 -45.42 92.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.553 -178.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 44.7 ttm -58.27 -43.04 87.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.049 0.452 . . . . 0.0 110.382 -178.34 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -60.5 -49.62 76.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.348 -178.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.75 ' HA ' HD12 ' A' ' 14' ' ' ILE . 13.7 tp -61.52 -30.67 70.78 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.412 -178.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.12 -50.12 71.75 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.621 0.248 . . . . 0.0 110.527 178.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.86 -41.05 86.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.976 0.417 . . . . 0.0 110.565 178.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.75 HD12 ' HA ' ' A' ' 11' ' ' LEU . 95.7 mt -54.21 -52.98 32.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.643 178.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 76.7 mttt -55.08 -26.8 40.32 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -177.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -61.98 -29.92 70.58 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 -177.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 47.7 mm -109.76 -40.49 4.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.699 0.285 . . . . 0.0 110.391 -176.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -115.37 83.23 10.28 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.241 -178.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -54.22 -21.39 22.39 Favored 'Trans proline' 0 N--CA 1.498 1.751 0 C-N-CA 121.444 1.429 . . . . 0.0 113.549 -175.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 34.7 p90 -97.29 20.52 11.38 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -175.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -102.89 130.87 50.07 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 173.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.487 ' O ' HD21 ' A' ' 11' ' ' LEU . 55.5 tttm -119.74 -35.19 3.57 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.625 0.25 . . . . 0.0 111.571 -175.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 85.4 tt0 -128.94 144.6 51.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.852 0.358 . . . . 0.0 110.585 -177.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.489 HG13 HD13 ' A' ' 11' ' ' LEU . 58.3 mt -99.04 131.02 47.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.803 173.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.3 t -90.42 -47.19 14.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.375 -0.375 . . . . 0.0 109.992 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.51 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.8 t0 -156.95 157.08 34.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.951 178.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.9 p -142.71 132.0 23.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.224 0.535 . . . . 0.0 111.293 -179.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.554 ' HG ' ' HD2' ' A' ' 107' ' ' PHE . 35.4 t -105.41 123.73 48.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.526 176.247 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 88.1 p -53.97 -37.16 63.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.455 -172.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -151.1 126.27 9.91 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.128 0.49 . . . . 0.0 111.449 -179.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.409 HG21 ' HB3' ' A' ' 52' ' ' PHE . 99.0 t -145.2 136.53 20.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.671 -177.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -127.47 149.85 49.92 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.966 -178.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -99.26 132.03 44.87 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-O 121.29 0.567 . . . . 0.0 111.931 -176.269 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -126.21 141.62 51.85 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.348 178.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 98.5 m -122.06 145.0 48.57 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 177.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -108.3 131.94 54.21 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 120.929 0.395 . . . . 0.0 110.451 176.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -102.99 114.34 28.55 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.858 176.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.4 m -67.86 -32.37 72.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.026 -177.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 86.9 p -62.32 -37.49 85.78 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.665 0.269 . . . . 0.0 111.129 -177.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -95.09 -21.48 18.52 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 32.0 t30 69.17 46.03 0.83 Allowed 'General case' 0 C--O 1.231 0.11 0 CA-C-O 121.505 0.669 . . . . 0.0 109.441 -177.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 72.7 tt0 -155.43 152.72 29.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.865 -177.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -89.34 143.76 26.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.387 177.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -124.35 128.53 49.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.832 176.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 26.4 pttm -75.45 140.16 42.71 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.031 178.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 52.5 p -92.3 170.21 9.97 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.111 -178.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -83.83 12.58 5.85 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 177.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.7 t -104.07 106.49 20.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.067 0.46 . . . . 0.0 110.281 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -132.38 115.79 16.03 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 176.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.65 176.41 38.97 Favored Glycine 0 CA--C 1.519 0.341 0 C-N-CA 120.153 -1.022 . . . . 0.0 112.5 -169.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.492 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -81.42 133.42 35.41 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 174.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.409 ' HB3' HG21 ' A' ' 31' ' ' VAL . 4.8 t80 -98.46 128.03 44.65 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -175.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.492 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.0 m-85 -132.43 142.66 49.35 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.353 177.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.626 HD11 HG23 ' A' ' 116' ' ' ILE . 69.6 mt -101.64 127.94 54.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 171.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.704 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 15.6 m-30 -108.47 135.55 49.56 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.812 0.339 . . . . 0.0 111.242 -176.299 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 37.1 t60 -114.9 143.26 45.42 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.935 173.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 41.5 tpt85 -142.1 148.94 39.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.456 . . . . 0.0 109.986 176.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -86.87 28.11 0.93 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -157.29 159.27 37.38 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -63.88 134.46 95.92 Favored Pre-proline 0 CA--C 1.537 0.475 0 CA-C-O 118.651 -0.69 . . . . 0.0 110.141 -175.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -67.43 140.81 54.57 Favored 'Cis proline' 0 N--CA 1.498 1.779 0 CA-C-N 121.603 1.608 . . . . 0.0 111.371 -3.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -68.54 -47.83 65.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.154 -177.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.473 ' HB3' HD12 ' A' ' 80' ' ' ILE . 76.8 m80 -142.57 135.61 28.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.322 0.582 . . . . 0.0 110.84 -177.014 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 5.2 t -149.82 152.2 34.77 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.35 -176.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 56.4 mt -110.45 139.51 33.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.596 -179.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -131.75 142.12 49.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.723 -176.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.5 mt -123.15 127.1 74.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.144 0.497 . . . . 0.0 109.783 172.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -93.13 99.54 12.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.505 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 -73.4 105.52 4.81 Favored 'General case' 0 C--N 1.332 -0.189 0 O-C-N 123.818 0.699 . . . . 0.0 110.881 -175.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 69.3 mtm180 -73.04 -42.43 63.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.602 -170.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.5 mt -72.94 -45.08 60.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.63 -174.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 40.4 t-20 -94.97 -3.38 48.6 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -175.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 72.0 p 50.8 43.58 28.2 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.429 0.633 . . . . 0.0 111.238 177.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 35.5 m -128.27 131.35 48.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.408 -179.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 77.1 p -74.43 130.02 38.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.429 -179.224 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -117.03 122.2 43.52 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 173.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 39.6 t -125.56 146.8 30.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 120.852 0.358 . . . . 0.0 110.802 -177.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -149.51 126.45 5.41 Favored Pre-proline 0 CA--C 1.538 0.485 0 CA-C-O 118.723 -0.656 . . . . 0.0 110.354 174.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -75.3 150.96 37.62 Favored 'Trans proline' 0 N--CA 1.498 1.769 0 C-N-CA 121.443 1.429 . . . . 0.0 112.033 177.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.473 HD12 ' HB3' ' A' ' 63' ' ' HIS . 65.2 mt -87.12 131.95 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.138 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.586 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 59.7 p -132.16 157.98 42.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.599 176.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.543 ' HA2' HD22 ' A' ' 124' ' ' LEU . . . -108.83 38.91 3.1 Favored Glycine 0 CA--C 1.523 0.592 0 C-N-CA 121.115 -0.564 . . . . 0.0 111.856 -177.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 10.5 t -103.68 -30.07 10.67 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.767 -0.217 . . . . 0.0 111.156 172.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.23 149.0 44.97 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.828 0.347 . . . . 0.0 111.201 -176.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -106.52 141.71 37.37 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 175.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 66.9 mt -111.8 159.75 18.0 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.789 0.328 . . . . 0.0 110.504 -178.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 37.7 mt-30 -151.12 145.19 25.29 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 177.003 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 26.2 t -102.51 109.31 20.9 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.512 178.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -106.81 103.76 48.53 Favored Pre-proline 0 C--N 1.329 -0.325 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 173.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -69.86 140.63 42.78 Favored 'Trans proline' 0 N--CA 1.497 1.7 0 CA-C-N 120.496 1.213 . . . . 0.0 112.074 -170.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -88.95 9.46 64.52 Favored 'Cis proline' 0 N--CA 1.5 1.905 0 CA-C-N 121.193 1.462 . . . . 0.0 113.697 -4.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -86.75 167.79 14.11 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.798 0.333 . . . . 0.0 111.109 -177.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 58.1 tp -115.75 133.97 55.49 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 170.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.474 HD21 ' HZ2' ' B' 1345 ' ' TRP . 12.4 tp -128.4 140.14 52.0 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.557 0.218 . . . . 0.0 110.469 -173.065 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 19.8 p90 -146.94 165.1 30.84 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.918 0.389 . . . . 0.0 110.592 176.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 37.8 mtt-85 -101.74 148.27 25.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.158 -178.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -128.83 163.94 24.12 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.867 0.841 . . . . 0.0 111.55 -177.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 32.0 mp0 -49.31 147.77 2.98 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.873 -176.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 79.6 mtm180 63.38 30.97 15.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.119 -0.946 . . . . 0.0 112.207 178.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 50.3 m 67.36 35.22 4.42 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.916 0.389 . . . . 0.0 111.535 167.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -101.49 152.71 20.44 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 179.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.519 HD13 ' CH2' ' B' 1345 ' ' TRP . 77.1 mt -111.07 129.6 66.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -179.178 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -137.96 149.39 46.1 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.897 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -143.96 168.85 26.37 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 111.274 -0.73 . . . . 0.0 111.274 -177.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -125.29 138.61 54.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.815 0.341 . . . . 0.0 110.602 -179.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 7.6 t90 -104.12 122.61 45.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.536 175.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.554 ' HD2' ' HG ' ' A' ' 28' ' ' SER . 35.9 m-85 -112.51 143.02 44.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.771 0.319 . . . . 0.0 110.554 -179.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 72.3 t80 -50.7 -35.87 33.29 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.702 178.38 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.9 t-20 -136.27 134.92 38.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.762 0.315 . . . . 0.0 110.462 179.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.6 t -61.68 -42.07 98.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.089 -177.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 -60.29 -43.54 96.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.375 0.607 . . . . 0.0 110.158 179.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 49.3 tt0 -56.62 -45.88 81.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.604 0.716 . . . . 0.0 110.0 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 38.4 t -60.56 -38.29 84.06 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.854 178.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -58.85 -46.22 88.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.923 0.392 . . . . 0.0 110.44 -177.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 51.2 mtp180 -58.98 -47.63 84.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.073 0.463 . . . . 0.0 110.552 -178.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.626 HG23 HD11 ' A' ' 54' ' ' ILE . 29.1 mm -58.23 -45.64 88.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.085 -179.03 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.0 p -59.29 -42.98 92.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.72 -177.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.6 -44.99 93.71 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.614 -0.995 . . . . 0.0 110.614 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.51 HD13 ' HB2' ' A' ' 26' ' ' ASP . 10.4 mt -58.67 -49.1 78.78 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.181 0.515 . . . . 0.0 110.491 -178.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.465 HG12 HD11 ' A' ' 124' ' ' LEU . 49.3 t -58.53 -41.42 81.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.265 -178.054 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.416 ' HA ' HD12 ' A' ' 124' ' ' LEU . 3.3 m-20 -58.5 -43.76 89.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.89 0.376 . . . . 0.0 110.593 -179.112 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -60.75 -40.78 98.58 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 111.262 -0.735 . . . . 0.0 111.262 -179.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.9 mt -65.69 -43.06 90.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.645 0.26 . . . . 0.0 111.414 179.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.543 HD22 ' HA2' ' A' ' 82' ' ' GLY . 18.1 mt -62.37 -44.93 95.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.258 -176.388 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 29.5 pttt -70.41 -37.62 74.49 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.124 -178.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 56.5 p -73.46 162.96 28.7 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.789 0.328 . . . . 0.0 110.444 179.106 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 22.9 pttm . . . . . 0 C--O 1.221 -0.44 0 CA-C-O 118.02 -0.991 . . . . 0.0 110.74 -179.92 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.266 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.84 137.92 34.61 Favored 'Trans proline' 0 N--CA 1.495 1.578 0 CA-C-N 118.836 1.318 . . . . 0.0 112.02 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -101.15 122.16 43.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.521 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -73.96 152.97 88.85 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.531 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -83.88 133.93 6.05 Favored 'Trans proline' 0 N--CA 1.491 1.368 0 C-N-CA 121.491 1.46 . . . . 0.0 112.249 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 79.0 mt -60.66 -41.62 95.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.429 179.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.3 mt -102.86 144.43 31.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.5 179.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -80.83 129.46 34.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.479 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -150.01 -66.94 0.21 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.542 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -102.07 152.46 20.96 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.573 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -112.48 141.59 46.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.435 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -102.33 159.87 28.06 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.511 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -69.59 146.53 61.52 Favored 'Trans proline' 0 N--CA 1.494 1.533 0 C-N-CA 121.326 1.351 . . . . 0.0 111.947 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -144.63 159.67 50.25 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.611 -179.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -57.92 128.95 30.92 Favored 'Trans proline' 0 N--CA 1.495 1.58 0 C-N-CA 121.195 1.263 . . . . 0.0 111.713 -178.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 100.76 -5.17 56.58 Favored Glycine 0 CA--C 1.534 1.234 0 CA-C-O 119.639 -0.534 . . . . 0.0 113.499 179.13 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -92.16 143.92 25.95 Favored 'General case' 0 C--O 1.231 0.083 0 CA-C-N 118.229 1.015 . . . . 0.0 110.535 177.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 6.5 ttt -66.61 118.17 51.55 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-O 118.555 -0.736 . . . . 0.0 110.273 -179.119 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -64.45 160.02 41.43 Favored 'Trans proline' 0 N--CA 1.499 1.795 0 CA-C-N 120.471 1.204 . . . . 0.0 111.663 177.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 63.0 t30 -95.39 111.13 23.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.85 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1338 ' ' LEU . . . . . . . . . . . . . 8.3 mt -74.23 136.92 75.41 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 118.55 -0.738 . . . . 0.0 109.532 178.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -79.13 139.57 15.12 Favored 'Trans proline' 0 N--CA 1.493 1.49 0 CA-C-N 120.211 1.111 . . . . 0.0 111.237 174.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 7.6 mtmp? -97.31 125.89 43.84 Favored Pre-proline 0 CA--C 1.536 0.436 0 CA-C-O 118.473 -0.775 . . . . 0.0 110.279 178.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -67.41 160.37 48.09 Favored 'Trans proline' 0 N--CA 1.497 1.712 0 C-N-CA 121.165 1.243 . . . . 0.0 111.627 175.33 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -49.82 156.86 2.94 Favored 'Trans proline' 0 N--CA 1.497 1.686 0 C-N-CA 121.288 1.326 . . . . 0.0 111.827 178.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 25.4 tp -50.04 -29.15 8.19 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -176.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 64.9 t80 -54.94 -38.27 67.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.932 0.396 . . . . 0.0 111.164 -177.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1345 ' ' TRP . . . . . 0.519 ' CH2' HD13 ' A' ' 102' ' ' ILE . 35.7 t90 -60.6 -48.2 82.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.206 -177.649 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -61.48 -48.18 82.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.965 0.412 . . . . 0.0 110.67 -176.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 58.1 tp60 -60.0 -46.11 90.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.819 -176.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -58.08 -46.31 85.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.693 -175.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -61.56 -51.36 68.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.904 -176.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1350 ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -58.95 -40.07 83.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.343 -174.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 68.7 tttt -69.12 -52.47 27.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.494 -177.334 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -55.6 -49.11 73.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.442 -175.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -70.8 -36.99 73.25 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.256 -178.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1354 ' ' ALA . . . . . . . . . . . . . . . -63.34 146.11 54.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.857 0.36 . . . . 0.0 110.63 -179.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 78.8 mt . . . . . 0 C--O 1.219 -0.524 0 CA-C-O 118.065 -0.969 . . . . 0.0 110.547 179.711 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' -6' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.381 0 N-CA-C 110.614 -0.995 . . . . 0.0 110.614 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' -5' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -66.02 130.65 24.88 Favored 'Trans proline' 0 N--CA 1.497 1.706 0 CA-C-N 119.285 1.543 . . . . 0.0 111.968 -175.853 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' -4' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -58.63 -40.68 84.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.782 -179.92 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' -3' ' ' MET . . . . . . . . . . . . . 72.1 mtm -90.6 161.58 15.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.644 -179.401 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' -2' ' ' ALA . . . . . . . . . . . . . . . -57.32 153.85 11.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.555 -179.973 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' -1' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -58.46 141.75 50.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.54 -179.72 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 0' ' ' LEU . . . . . . . . . . . . . 28.4 tp -57.05 -39.64 75.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.898 -179.884 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.5 ttm -84.85 120.0 25.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.733 -179.248 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -143.76 83.93 1.77 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.326 179.112 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -78.99 140.1 38.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.841 -178.428 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.4 mp0 -67.12 -30.56 70.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.59 178.394 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 24.7 m -55.27 -38.6 68.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.823 0.344 . . . . 0.0 110.857 -178.414 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.4 mm -59.52 -46.85 92.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.991 0.424 . . . . 0.0 110.041 -179.005 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.4 m -58.68 -44.38 90.21 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.15 0.5 . . . . 0.0 110.449 -178.339 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -59.2 -45.32 91.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.644 -178.571 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 89.6 mtp -58.29 -42.84 87.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.996 0.426 . . . . 0.0 110.463 -178.221 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -59.26 -49.44 77.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.027 0.441 . . . . 0.0 110.146 -178.925 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.707 ' HA ' HD12 ' A' ' 14' ' ' ILE . 14.1 tp -61.31 -30.36 70.45 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.36 -179.609 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.98 -49.91 72.85 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 122.224 -0.298 . . . . 0.0 110.579 177.862 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.94 -41.55 83.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.963 0.411 . . . . 0.0 110.464 178.422 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.72 HG23 ' CZ ' ' A' ' 55' ' ' TYR . 92.6 mt -54.16 -53.03 32.1 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.748 179.23 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.6 mttp -53.8 -27.64 30.47 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -178.134 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -60.46 -32.2 71.18 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -176.503 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.513 HG21 ' CE2' ' A' ' 66' ' ' PHE . 47.3 mm -107.4 -41.08 5.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.864 0.364 . . . . 0.0 110.44 -176.031 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -115.13 83.36 9.83 Favored Pre-proline 0 CA--C 1.534 0.332 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.206 -178.691 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -53.65 -20.8 17.58 Favored 'Trans proline' 0 N--CA 1.498 1.759 0 C-N-CA 121.505 1.47 . . . . 0.0 113.422 -176.254 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -99.23 22.03 11.08 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.756 0.651 . . . . 0.0 112.756 -175.225 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -110.57 127.36 55.18 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 173.262 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.5 ' O ' HD21 ' A' ' 11' ' ' LEU . 16.7 pttp -122.99 -24.54 4.74 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -175.788 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.3 tp10 -127.77 140.26 52.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.726 0.298 . . . . 0.0 110.594 -179.768 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.486 HG13 HD13 ' A' ' 11' ' ' LEU . 52.6 mt -98.1 132.17 43.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.341 -0.39 . . . . 0.0 109.998 174.239 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 45.1 t -92.87 -47.13 13.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.173 179.938 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.499 ' HB2' HD13 ' A' ' 119' ' ' LEU . 5.9 t0 -155.02 156.31 35.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.038 178.69 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.4 p -143.03 131.98 22.89 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.098 0.475 . . . . 0.0 111.125 179.683 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.3 t -107.22 125.91 51.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.663 177.39 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 87.3 p -54.33 -37.77 65.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.309 -172.255 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -151.84 126.62 9.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.146 0.498 . . . . 0.0 111.688 -178.997 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.428 HG21 ' HB3' ' A' ' 52' ' ' PHE . 99.2 t -145.26 140.17 22.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.474 -177.713 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -129.15 149.88 50.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.147 -178.067 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.464 ' HD1' HG21 ' A' ' 46' ' ' THR . 32.3 t80 -97.89 133.62 42.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.187 0.518 . . . . 0.0 111.749 -176.383 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.406 ' CD2' HD11 ' B' 1338 ' ' LEU . 31.5 m-85 -126.56 142.0 51.68 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.467 178.973 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.606 HG23 ' CZ ' ' A' ' 103' ' ' ARG . 82.0 m -120.47 146.77 45.92 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 177.818 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -108.48 131.94 54.31 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.988 0.423 . . . . 0.0 110.471 176.125 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 -104.37 115.98 31.33 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.962 177.51 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 87.9 p -69.06 -31.46 70.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.064 -176.816 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.2 t -60.9 -39.84 90.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.763 0.316 . . . . 0.0 110.876 -177.58 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -94.43 -21.38 18.96 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -178.703 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 69.79 43.62 0.93 Allowed 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.355 0.598 . . . . 0.0 109.748 -177.922 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 90.3 mt-10 -151.26 162.9 40.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.103 -177.77 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.457 ' CB ' HD12 ' B' 1338 ' ' LEU . 88.0 m95 -94.76 142.53 27.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.373 177.639 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -124.34 126.69 46.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 0.0 109.905 175.527 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 38.8 tttp -73.95 139.81 45.13 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.394 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.464 HG21 ' HD1' ' A' ' 33' ' ' PHE . 67.2 p -92.4 171.89 8.75 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.153 -178.365 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -83.75 12.49 5.88 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 178.681 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.5 t -102.43 106.47 19.94 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-O 120.964 0.411 . . . . 0.0 110.291 179.719 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -131.1 114.89 15.7 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 176.717 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -162.61 176.52 38.93 Favored Glycine 0 CA--C 1.519 0.295 0 C-N-CA 120.054 -1.069 . . . . 0.0 112.411 -169.67 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.489 ' HB1' ' HE1' ' A' ' 53' ' ' PHE . . . -81.26 134.7 35.64 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 175.145 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.428 ' HB3' HG21 ' A' ' 31' ' ' VAL . 5.4 t80 -98.3 127.57 44.3 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.079 -176.473 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.489 ' HE1' ' HB1' ' A' ' 51' ' ' ALA . 8.0 m-85 -131.84 142.27 49.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.276 177.654 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.689 HD11 HG23 ' A' ' 116' ' ' ILE . 68.5 mt -101.59 127.71 54.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 172.308 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.72 ' CZ ' HG23 ' A' ' 14' ' ' ILE . 16.3 m-30 -108.47 136.86 47.38 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.838 0.352 . . . . 0.0 111.216 -175.922 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 68.2 t60 -114.68 141.64 47.55 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.34 175.295 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -142.31 146.93 35.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.835 176.459 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -86.77 28.09 0.92 Allowed 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.998 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -158.37 172.8 17.69 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.765 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -64.04 124.68 86.07 Favored Pre-proline 0 CA--C 1.539 0.535 0 CA-C-O 118.55 -0.738 . . . . 0.0 110.081 -178.129 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -79.11 140.98 60.46 Favored 'Cis proline' 0 N--CA 1.495 1.609 0 CA-C-N 121.79 1.675 . . . . 0.0 111.537 -1.677 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -63.73 -46.37 85.67 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.922 -177.613 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -142.37 136.22 29.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.274 0.559 . . . . 0.0 110.664 -177.46 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.3 t -150.26 151.33 32.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.454 -177.396 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.461 HG13 HD11 ' A' ' 80' ' ' ILE . 50.1 mt -110.86 139.51 34.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -179.228 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.513 ' CE2' HG21 ' A' ' 17' ' ' ILE . 62.9 t80 -131.83 142.06 49.61 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.81 -176.796 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 60.9 mt -123.82 127.31 73.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.214 0.531 . . . . 0.0 109.813 172.463 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 -94.25 99.54 11.76 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.011 -0.995 . . . . 0.0 109.445 -179.756 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.8 t-20 -74.48 105.75 5.76 Favored 'General case' 0 C--N 1.332 -0.165 0 O-C-N 123.728 0.642 . . . . 0.0 110.951 -175.474 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -71.84 -42.11 67.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.602 -170.879 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.8 mt -73.32 -45.17 56.88 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.781 -173.794 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 52.3 m-20 -95.07 -3.42 48.19 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -175.573 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.1 m 53.04 42.76 32.25 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 121.493 0.663 . . . . 0.0 111.039 177.095 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.1 m -128.49 132.68 48.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.585 -178.146 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 86.8 p -76.66 130.71 38.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.412 -179.296 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -118.0 122.26 42.74 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 172.965 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.427 HG22 ' HD2' ' A' ' 66' ' ' PHE . 31.4 t -125.55 146.39 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-O 120.745 0.307 . . . . 0.0 110.764 -176.399 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -147.88 126.37 6.09 Favored Pre-proline 0 CA--C 1.539 0.526 0 CA-C-O 118.633 -0.699 . . . . 0.0 110.43 173.836 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -75.47 150.91 36.83 Favored 'Trans proline' 0 N--CA 1.499 1.83 0 C-N-CA 121.453 1.435 . . . . 0.0 112.282 177.682 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.461 HD11 HG13 ' A' ' 65' ' ' ILE . 68.3 mt -93.21 134.64 30.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.229 177.715 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 58.1 p -132.14 158.06 42.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.702 177.401 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -94.27 34.96 4.4 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.059 -178.567 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.0 t -111.09 -21.15 12.1 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 173.79 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.9 mt -68.61 149.04 49.63 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-O 120.925 0.393 . . . . 0.0 111.379 -176.149 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -115.34 135.87 53.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.682 176.265 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 70.5 mt -114.81 155.21 27.19 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.913 0.387 . . . . 0.0 110.823 -176.963 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -148.7 142.77 25.93 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 178.317 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 28.6 t -103.52 109.19 20.75 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.645 -0.422 . . . . 0.0 110.919 -179.849 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.0 mt-30 -106.8 103.81 48.71 Favored Pre-proline 0 C--N 1.329 -0.318 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 171.333 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.09 141.91 49.36 Favored 'Trans proline' 0 N--CA 1.496 1.666 0 CA-C-N 120.477 1.206 . . . . 0.0 111.964 -172.126 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -89.86 11.66 58.31 Favored 'Cis proline' 0 N--CA 1.5 1.853 0 CA-C-N 121.108 1.431 . . . . 0.0 113.629 -3.613 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -90.41 168.25 12.01 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-O 120.62 0.248 . . . . 0.0 110.901 -178.365 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 54.6 tp -118.39 135.02 54.58 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 171.52 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.462 HD11 ' CG2' ' A' ' 102' ' ' ILE . 9.5 tp -126.97 139.15 53.26 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.539 0.209 . . . . 0.0 110.563 -174.487 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -143.13 148.63 36.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.986 0.422 . . . . 0.0 110.178 175.543 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 25.9 mtm180 -103.44 150.56 23.74 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.135 -175.854 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 24.1 m120 -129.98 162.69 28.09 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 121.812 0.815 . . . . 0.0 111.221 -179.769 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 51.6 tt0 -49.51 149.55 2.27 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.72 -177.014 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 64.76 30.88 12.17 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.351 -0.841 . . . . 0.0 112.116 -179.834 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 18.2 m 66.64 35.11 5.45 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.958 0.409 . . . . 0.0 111.605 165.652 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 46.9 mtp85 -98.99 143.29 29.45 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.988 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.623 HD13 ' CH2' ' B' 1345 ' ' TRP . 75.9 mt -117.68 126.1 74.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-O 121.181 0.515 . . . . 0.0 110.055 -175.412 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.606 ' CZ ' HG23 ' A' ' 35' ' ' THR . 81.4 mmt-85 -130.95 147.35 52.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.444 178.788 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -139.66 166.42 25.6 Favored Glycine 0 CA--C 1.523 0.533 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 -178.143 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -125.33 139.8 53.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.878 0.371 . . . . 0.0 110.516 -179.741 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 15.5 t90 -107.49 124.81 50.44 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.464 174.314 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.407 ' CD2' HG22 ' A' ' 31' ' ' VAL . 55.8 m-85 -113.84 143.34 44.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.785 0.326 . . . . 0.0 110.667 -179.481 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -51.24 -35.96 39.47 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.618 178.232 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 35.5 t-20 -136.04 134.4 38.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.371 179.39 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.0 t -60.79 -41.42 95.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.012 -177.654 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -59.82 -43.21 94.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.315 0.578 . . . . 0.0 110.194 178.881 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -56.78 -45.32 82.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.511 0.672 . . . . 0.0 109.966 179.05 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 42.2 t -59.94 -39.04 84.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.711 178.351 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -59.31 -45.98 89.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.914 0.388 . . . . 0.0 110.577 -177.303 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 60.4 ttm-85 -59.36 -48.45 81.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.998 0.428 . . . . 0.0 110.523 -177.923 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.689 HG23 HD11 ' A' ' 54' ' ' ILE . 30.8 mm -58.23 -45.97 88.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.058 -178.709 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 60.3 p -59.28 -43.07 92.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.665 -177.37 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.79 -44.37 94.25 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.654 -0.978 . . . . 0.0 110.654 -178.879 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.499 HD13 ' HB2' ' A' ' 26' ' ' ASP . 10.8 mt -58.4 -49.39 77.43 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.162 0.506 . . . . 0.0 110.528 -178.428 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 52.6 t -59.12 -42.63 87.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.13 -178.597 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 121' ' ' ASN . . . . . 0.405 ' HA ' HD12 ' A' ' 124' ' ' LEU . 87.4 m-20 -57.68 -41.96 82.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.795 0.331 . . . . 0.0 110.594 -178.95 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -60.84 -45.79 95.8 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 110.954 -0.859 . . . . 0.0 110.954 -179.806 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 58.6 mt -58.68 -42.28 88.17 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.901 0.381 . . . . 0.0 110.548 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.405 HD12 ' HA ' ' A' ' 121' ' ' ASN . 59.1 mt -60.13 -41.68 93.18 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.796 -179.38 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 25.6 pttt -88.36 2.38 52.71 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 113.264 0.838 . . . . 0.0 113.264 -179.208 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 90.4 p -116.09 149.22 39.32 Favored 'General case' 0 N--CA 1.461 0.102 0 CA-C-N 118.138 0.426 . . . . 0.0 110.391 179.135 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 2.0 ttmp? . . . . . 0 C--O 1.22 -0.448 0 CA-C-O 117.923 -1.037 . . . . 0.0 110.542 -179.546 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B 1318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B 1319 ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -49.38 142.68 22.06 Favored 'Trans proline' 0 N--CA 1.496 1.641 0 C-N-CA 121.325 1.35 . . . . 0.0 112.045 179.976 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1320 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -99.53 124.88 45.11 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.521 179.97 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1321 ' ' ASP . . . . . . . . . . . . . 36.4 t0 -83.18 126.21 72.68 Favored Pre-proline 0 CA--C 1.537 0.443 0 CA-C-O 118.491 -0.766 . . . . 0.0 109.921 -179.897 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1322 ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -73.36 -30.09 10.58 Favored 'Trans proline' 0 N--CA 1.497 1.694 0 C-N-CA 121.143 1.229 . . . . 0.0 112.402 179.567 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1323 ' ' LEU . . . . . . . . . . . . . 28.0 tp -56.21 -40.05 73.42 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.84 -179.554 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1324 ' ' LEU . . . . . . . . . . . . . 78.6 mt -92.42 140.89 29.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.563 -179.99 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1325 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -99.52 135.8 40.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.534 179.875 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1326 ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -60.49 -40.45 91.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.781 -179.923 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1327 ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -130.21 125.16 34.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.476 179.915 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1328 ' ' ARG . . . . . . . . . . . . . 49.3 ttt85 -113.15 149.09 34.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.391 179.922 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1329 ' ' ALA . . . . . . . . . . . . . . . -56.37 153.81 18.52 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.742 -179.263 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1330 ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -54.71 157.13 13.12 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 121.384 1.389 . . . . 0.0 112.108 -179.607 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1331 ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -107.03 99.94 29.34 Favored Pre-proline 0 CA--C 1.532 0.272 0 CA-C-O 118.987 -0.53 . . . . 0.0 110.321 179.353 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1332 ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -57.99 128.92 30.74 Favored 'Trans proline' 0 N--CA 1.497 1.714 0 C-N-CA 121.017 1.145 . . . . 0.0 111.471 -179.993 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1333 ' ' GLY . . . . . . . . . . . . . . . 99.59 -5.04 58.35 Favored Glycine 0 CA--C 1.536 1.395 0 C-N-CA 121.25 -0.5 . . . . 0.0 113.364 -179.248 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1334 ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -55.13 145.45 21.05 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 118.183 0.991 . . . . 0.0 110.858 178.953 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1335 ' ' MET . . . . . . . . . . . . . 7.7 ttp -61.15 143.51 92.29 Favored Pre-proline 0 CA--C 1.533 0.314 0 CA-C-O 119.067 -0.492 . . . . 0.0 110.058 -179.319 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1336 ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -59.45 149.23 82.97 Favored 'Trans proline' 0 N--CA 1.497 1.69 0 C-N-CA 121.241 1.294 . . . . 0.0 111.721 177.671 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1337 ' ' ASN . . . . . . . . . . . . . 26.2 m120 -106.28 113.85 27.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.729 -179.555 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1338 ' ' LEU . . . . . 0.457 HD12 ' CB ' ' A' ' 43' ' ' TRP . 13.1 mt -80.34 153.8 74.15 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.255 -0.429 . . . . 0.0 109.941 178.193 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B 1339 ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -79.01 139.75 15.44 Favored 'Trans proline' 0 N--CA 1.492 1.401 0 C-N-CA 121.172 1.248 . . . . 0.0 111.343 174.986 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1340 ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -97.08 125.97 44.01 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-O 118.451 -0.785 . . . . 0.0 109.886 179.901 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1341 ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -78.13 161.88 29.11 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 121.258 1.305 . . . . 0.0 111.868 176.177 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1342 ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -50.86 150.01 13.54 Favored 'Trans proline' 0 N--CA 1.494 1.524 0 C-N-CA 121.293 1.329 . . . . 0.0 111.642 177.811 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1343 ' ' LEU . . . . . . . . . . . . . 81.0 mt -49.91 -28.36 6.56 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -176.611 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1344 ' ' PHE . . . . . . . . . . . . . 68.3 t80 -55.37 -38.39 68.76 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.859 0.361 . . . . 0.0 111.173 -176.923 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1345 ' ' TRP . . . . . 0.623 ' CH2' HD13 ' A' ' 102' ' ' ILE . 9.2 t90 -60.6 -48.06 83.46 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.301 -176.57 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B 1346 ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -64.0 -48.5 76.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.898 0.38 . . . . 0.0 110.863 -176.983 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1347 ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.36 -45.47 91.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.87 -176.326 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1348 ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -59.75 -47.33 86.1 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.612 -176.424 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1349 ' ' ALA . . . . . . . . . . . . . . . -59.12 -46.93 87.07 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.032 0.444 . . . . 0.0 110.753 -177.436 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1350 ' ' GLN . . . . . 0.473 ' O ' ' HB3' ' B' 1354 ' ' ALA . 62.0 tt0 -60.23 -44.39 95.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.286 -176.284 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B 1351 ' ' LYS . . . . . . . . . . . . . 96.3 mttt -63.22 -46.9 84.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.188 -177.06 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1352 ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -58.34 -49.01 78.73 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.059 -178.193 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1353 ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -90.18 15.06 10.99 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 179.464 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1354 ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' B' 1350 ' ' GLN . . . -167.4 123.05 1.08 Allowed 'General case' 0 C--O 1.231 0.13 0 CA-C-O 120.838 0.351 . . . . 0.0 110.585 179.362 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B 1355 ' ' LEU . . . . . . . . . . . . . 79.8 mt . . . . . 0 C--O 1.221 -0.411 0 CA-C-O 117.911 -1.042 . . . . 0.0 110.405 179.714 . . . . . . . . 0 0 . 1 stop_ save_