data_1zuf_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 1zuf _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 ' 6' ' ' MET . . . . . . . . . . . . . 35.6 mtm . . . . . 0 CA--C 1.527 0.077 0 CA-C-O 120.806 0.336 . . . . 0.0 110.787 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 172.57 172.45 0.11 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.793 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.36 176.44 0.25 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.133 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.2 p -111.11 29.68 7.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.969 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 9.3 m0 -54.55 -31.97 57.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.18 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.0 t -97.45 -57.92 2.13 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.987 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 21.3 t-80 -57.85 -26.8 62.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.054 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.97 163.46 0.1 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.935 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 164.88 174.46 34.63 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.556 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.5 t -91.94 105.66 16.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.854 0.359 . . . . 0.0 111.122 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.9 t -79.02 96.09 5.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.84 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.2 -164.3 1.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.888 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 77.1 m-20 -74.46 138.55 43.32 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.86 0.362 . . . . 0.0 111.214 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.403 ' HA ' ' HG2' ' A' ' 38' ' ' LYS . 0.7 OUTLIER -52.52 -29.25 24.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.2 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.0 t -103.87 33.45 3.42 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.002 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -65.44 133.99 52.48 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 121.287 0.565 . . . . 0.0 110.641 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.65 14.73 7.89 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.404 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.18 38.5 0.72 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.001 0.429 . . . . 0.0 110.39 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.98 154.51 19.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.17 -179.48 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.441 ' CB ' ' CD ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -105.54 179.08 0.98 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.876 -179.896 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.441 ' CD ' ' CB ' ' A' ' 25' ' ' LYS . 33.1 Cg_exo -59.91 80.22 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.514 2.143 . . . . 0.0 112.402 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.84 164.03 1.27 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.05 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -124.78 177.55 5.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.059 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.419 ' CE2' HG22 ' A' ' 30' ' ' THR . 65.7 p-90 -47.55 -29.91 3.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.397 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.419 HG22 ' CE2' ' A' ' 29' ' ' TRP . 20.0 p -65.48 151.99 45.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.907 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 28.4 p90 -137.06 -179.14 5.53 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.887 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.5 t -89.92 -66.29 0.94 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.828 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 178.53 -56.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.66 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -89.98 150.16 22.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.742 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -69.15 -8.03 41.73 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.933 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -89.76 -19.79 24.32 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.003 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 58.6 mm-40 -125.76 131.6 52.48 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.774 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.403 ' HG2' ' HA ' ' A' ' 19' ' ' LYS . 5.2 ptpt -117.3 153.56 32.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.154 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.9 t -96.33 94.63 7.56 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.609 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -76.9 177.19 7.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.082 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.81 115.94 11.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.886 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 15.6 p90 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.227 -0.892 . . . . 0.0 112.118 -179.671 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 3.5 mmt . . . . . 0 N--CA 1.457 -0.088 0 CA-C-O 120.819 0.342 . . . . 0.0 110.869 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 175.99 170.72 0.39 Allowed 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.833 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.45 -172.93 0.38 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.049 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.2 p -117.1 24.85 10.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.993 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 7.8 m95 -57.36 -27.3 62.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.142 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.7 t -89.94 -32.88 16.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.969 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -80.03 -29.62 39.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.845 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.6 m 62.12 84.31 0.14 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.913 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -113.82 -145.39 9.1 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.837 -0.696 . . . . 0.0 112.477 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.4 t -131.13 102.65 6.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.822 0.344 . . . . 0.0 111.082 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.9 t -79.81 103.27 9.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.952 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.12 -165.48 1.37 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.66 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.457 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 9.0 t70 -71.27 136.53 47.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.962 0.411 . . . . 0.0 110.972 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.97 -36.35 27.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.027 0.441 . . . . 0.0 111.049 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.6 t -101.43 31.85 3.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.966 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.457 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 7.6 tp10 -61.94 129.95 43.33 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.214 0.531 . . . . 0.0 110.447 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.6 16.2 4.07 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.632 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -150.18 40.19 0.78 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.99 0.424 . . . . 0.0 110.374 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.85 147.79 23.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.215 -179.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.418 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 0.1 OUTLIER -98.2 172.08 5.2 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.638 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.418 ' HD2' ' HB3' ' A' ' 25' ' ' LYS . 45.3 Cg_exo -57.11 83.38 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.447 2.098 . . . . 0.0 112.541 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -54.67 168.19 0.3 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.253 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -120.26 173.17 7.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.867 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.445 ' CE2' HG22 ' A' ' 30' ' ' THR . 46.6 p-90 -47.07 -29.02 1.93 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.408 -179.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.445 HG22 ' CE2' ' A' ' 29' ' ' TRP . 44.3 p -65.33 165.1 12.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.087 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -135.39 -179.41 5.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.842 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 49.0 t -93.39 -78.65 0.42 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.007 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -179.49 -51.44 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.01 -179.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -89.87 144.27 26.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.888 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -66.75 -12.06 57.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.686 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -90.07 -22.63 21.72 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.126 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 -128.06 138.55 52.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.79 0.329 . . . . 0.0 111.059 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.28 158.36 31.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.043 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 33.9 t -90.52 113.67 25.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.957 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -98.51 179.45 4.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.788 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.9 127.26 30.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.786 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 29.0 p90 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.232 -0.889 . . . . 0.0 112.17 -179.555 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 8.8 mmm . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.793 0.33 . . . . 0.0 110.894 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 168.42 155.03 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.795 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.405 ' HB1' ' CD1' ' A' ' 10' ' ' TRP . . . -59.81 166.67 2.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.021 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 29.3 p -105.09 20.06 19.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.25 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.405 ' CD1' ' HB1' ' A' ' 8' ' ' ALA . 14.6 m95 -57.52 -27.99 63.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.762 0.315 . . . . 0.0 111.092 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.9 t -90.09 -64.6 1.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.951 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.5 -23.93 59.22 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.154 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 66.21 147.85 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.931 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -171.35 -164.68 27.43 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.526 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.5 t -115.96 95.97 4.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.814 0.34 . . . . 0.0 111.148 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.4 t -72.02 95.84 1.65 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.778 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.4 -168.04 1.99 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.774 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -74.9 136.78 41.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.8 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.7 mttm -53.83 -28.06 33.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.918 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 29.3 t -105.31 34.53 3.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.739 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -73.22 149.29 42.95 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.297 0.57 . . . . 0.0 110.616 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -98.65 17.57 18.89 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.127 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -148.01 28.93 0.91 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.833 0.349 . . . . 0.0 110.682 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.35 147.47 23.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.995 -179.627 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.42 ' HB3' ' HB3' ' A' ' 41' ' ' GLU . 1.1 mptp? -101.07 177.54 1.49 Allowed Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.747 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.411 ' CD ' ' CB ' ' A' ' 25' ' ' LYS . 47.5 Cg_exo -56.67 82.86 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.434 2.089 . . . . 0.0 112.525 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.406 ' N ' ' O ' ' A' ' 25' ' ' LYS . 5.5 ppp? -52.82 164.42 0.38 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.299 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -124.49 174.53 7.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.051 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.408 ' CE2' HG23 ' A' ' 30' ' ' THR . 55.2 p-90 -49.16 -30.66 7.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.287 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.408 HG23 ' CE2' ' A' ' 29' ' ' TRP . 13.2 p -58.66 158.24 8.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.899 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -129.46 172.38 11.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.859 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 40.8 t -90.03 -73.78 0.51 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.937 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -179.13 -49.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.736 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -89.97 140.91 29.17 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.787 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -70.53 -6.98 40.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.946 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -89.91 -14.03 35.05 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.17 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.41 161.59 35.03 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.801 0.334 . . . . 0.0 110.787 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -130.54 162.53 29.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.113 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.6 t -99.91 104.77 16.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.86 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 m -81.31 176.87 9.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.737 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.42 ' HB3' ' HB3' ' A' ' 25' ' ' LYS . 0.3 OUTLIER -71.05 116.62 11.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.717 179.908 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 1.8 p90 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.245 -0.884 . . . . 0.0 112.198 -179.512 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 72.3 mtp . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.81 0.338 . . . . 0.0 111.16 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.451 ' N ' ' CE2' ' A' ' 31' ' ' TYR . 0.0 OUTLIER 174.58 157.62 0.16 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.723 179.728 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.79 156.81 10.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.235 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.6 p -115.1 25.8 10.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.966 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 11.8 m0 -55.45 -38.44 69.05 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.131 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -108.26 30.35 6.49 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.046 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -147.36 21.21 1.2 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.146 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 53.25 178.84 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.781 0.324 . . . . 0.0 111.025 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 145.42 171.79 15.32 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.615 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.4 t -120.19 85.12 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.837 0.351 . . . . 0.0 111.074 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.7 t -61.69 94.78 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.976 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.58 -163.63 0.92 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.624 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -88.59 137.73 32.06 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.738 0.304 . . . . 0.0 110.897 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.1 mtpp -50.86 -30.77 15.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.913 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.9 t -99.23 25.12 7.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.851 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.4 ' CG ' ' HB2' ' A' ' 24' ' ' CYS . 18.6 tp10 -60.51 118.26 6.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.087 0.47 . . . . 0.0 110.565 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.29 12.31 18.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.558 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -150.08 40.13 0.78 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.169 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.4 ' HB2' ' CG ' ' A' ' 21' ' ' GLU . 0.4 OUTLIER -98.84 179.17 4.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.609 -179.181 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.7 mmtt -115.18 164.69 16.13 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.289 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -50.52 90.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.483 2.122 . . . . 0.0 112.651 -179.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.413 ' CB ' ' HA ' ' A' ' 40' ' ' CYS . 0.1 OUTLIER -60.15 168.54 1.91 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.98 179.727 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -122.26 174.3 7.07 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.931 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.456 ' CD2' HG21 ' A' ' 30' ' ' THR . 37.5 p-90 -49.38 -26.76 3.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.451 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.456 HG21 ' CD2' ' A' ' 29' ' ' TRP . 15.7 p -66.94 157.92 32.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.85 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.451 ' CE2' ' N ' ' A' ' 7' ' ' GLN . 15.1 p90 -137.37 177.51 7.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.967 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 4.1 t -89.92 -67.37 0.85 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.986 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -179.45 -53.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.701 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 55.3 t30 -90.0 152.44 21.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.751 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -66.79 -11.55 55.52 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.824 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -90.01 -22.64 21.78 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.082 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -114.87 134.35 55.21 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.753 0.311 . . . . 0.0 110.992 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.63 154.82 37.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.121 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 9.0 t -87.5 99.28 11.91 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.589 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.413 ' HA ' ' CB ' ' A' ' 27' ' ' MET . 0.7 OUTLIER -79.83 174.84 11.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.302 -179.548 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -58.13 106.77 0.4 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.005 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 10.5 p90 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.235 -0.888 . . . . 0.0 112.053 -179.584 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 30.6 mmm . . . . . 0 CA--C 1.527 0.065 0 CA-C-O 120.768 0.318 . . . . 0.0 110.752 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 169.94 179.82 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.817 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.442 ' CB ' ' CE2' ' A' ' 10' ' ' TRP . . . -100.51 -177.21 3.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.133 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 27.3 p -109.89 27.77 9.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.0 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.442 ' CE2' ' CB ' ' A' ' 8' ' ' ALA . 9.7 m95 -54.49 -31.25 55.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.033 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.4 t -97.3 -52.2 3.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.849 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -59.62 -25.95 65.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.945 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.5 p 63.32 143.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.974 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -165.87 -134.48 1.68 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.5 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.8 t -141.06 82.02 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.859 0.362 . . . . 0.0 111.068 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.0 t -66.37 89.32 0.14 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.808 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.18 -166.26 1.2 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.738 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.66 136.23 41.92 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.825 0.345 . . . . 0.0 110.91 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.4 mttt -63.53 -34.95 78.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.653 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.1 t -104.79 34.76 3.02 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.41 179.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.85 -175.63 3.55 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.351 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -123.04 17.96 10.04 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.496 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.02 40.0 0.78 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.88 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -97.14 146.97 24.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.039 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.487 ' CB ' ' HD2' ' A' ' 26' ' ' PRO . 1.0 OUTLIER -106.15 170.83 5.37 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.763 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.487 ' HD2' ' CB ' ' A' ' 25' ' ' LYS . 9.5 Cg_endo -52.49 87.72 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.393 2.062 . . . . 0.0 112.246 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.402 ' N ' ' O ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -62.46 165.77 5.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.137 -179.902 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -115.13 177.69 4.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.012 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.413 ' CE2' HG22 ' A' ' 30' ' ' THR . 64.1 p-90 -49.97 -36.18 27.19 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.292 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.413 HG22 ' CE2' ' A' ' 29' ' ' TRP . 19.1 p -58.92 148.78 29.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.967 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 16.8 p90 -130.68 179.96 5.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.917 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.5 t -94.43 -69.5 0.75 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.892 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.4 pp20? 178.54 -46.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.862 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -96.66 146.87 24.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.862 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -69.14 -8.3 44.24 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.871 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -89.8 -19.28 24.88 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.059 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -129.39 141.12 51.14 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.812 0.339 . . . . 0.0 110.853 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -131.78 158.06 42.22 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.095 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 17.8 t -86.26 93.15 8.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.591 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -82.07 166.41 19.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.975 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.88 139.23 52.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.935 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.237 -0.887 . . . . 0.0 112.277 -179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 8.3 mtt . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.747 0.308 . . . . 0.0 110.88 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 178.05 -172.45 0.12 Allowed 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.924 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.59 157.29 35.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.254 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.5 p -107.89 25.45 11.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.97 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 18.1 m0 -55.99 -32.1 63.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.256 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.0 t -89.98 -34.3 16.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.962 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -70.0 -16.42 63.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.276 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 67.34 126.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.859 0.361 . . . . 0.0 110.929 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -172.87 -167.8 33.3 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.825 -0.703 . . . . 0.0 112.288 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.422 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 24.4 t -122.84 95.16 3.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.967 0.413 . . . . 0.0 111.166 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.7 t -62.51 86.25 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.894 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.38 -163.21 1.02 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.765 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -96.07 142.01 28.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.842 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.16 -40.69 90.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.894 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.7 t -73.42 -11.89 60.62 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.136 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -102.62 95.14 6.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.829 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.43 ' N ' ' CD ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -97.67 40.29 1.17 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.967 -179.794 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -98.35 24.76 6.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.96 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -121.69 -173.73 2.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.683 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.26 155.4 84.14 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.645 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -64.16 103.33 0.42 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.418 2.079 . . . . 0.0 112.328 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 12.6 ptm -60.81 163.62 5.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.129 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.437 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -134.41 104.76 6.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.824 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.437 ' CD1' ' O ' ' A' ' 28' ' ' ALA . 0.5 OUTLIER 47.75 -178.71 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.418 -179.815 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.427 ' OG1' ' CE2' ' A' ' 29' ' ' TRP . 0.2 OUTLIER 63.37 161.72 0.1 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.633 -179.461 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -139.32 -178.86 5.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.945 0.402 . . . . 0.0 111.229 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 36.1 t -89.84 -64.03 1.2 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.762 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -178.47 -44.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.679 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 60.5 t30 -107.89 150.49 26.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.663 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -69.85 -7.0 36.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.926 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -89.74 -17.83 27.51 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.965 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -119.13 149.34 41.87 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.817 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -121.52 162.43 20.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.952 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 15.4 t -95.82 83.21 3.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.825 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.422 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -55.7 154.04 7.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.668 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.65 107.99 5.43 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.059 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 28.4 p90 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.079 -179.6 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 40.2 mtt . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.72 0.295 . . . . 0.0 110.869 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 175.53 160.41 0.25 Allowed 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.918 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.37 153.66 40.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.184 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.5 p -113.81 19.6 16.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.18 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 50.3 m0 -56.51 -44.74 81.04 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.831 0.348 . . . . 0.0 111.082 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.85 -20.21 23.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.239 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 13.0 m-70 -96.18 24.28 5.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.069 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.0 t 56.95 179.95 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.989 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 139.24 166.0 10.45 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.476 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.2 t -116.1 87.86 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.868 0.366 . . . . 0.0 111.17 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 49.5 t -67.05 99.69 0.68 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.939 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.51 -164.65 1.12 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.603 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -83.1 138.3 33.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.824 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.1 mttm -49.76 -29.81 8.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.949 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.8 t -103.4 28.17 6.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.711 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 -60.63 117.52 5.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.715 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.76 12.92 13.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.446 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -149.29 42.67 0.93 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.204 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -104.21 173.18 6.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.479 -179.112 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -104.34 168.13 8.98 Favored Pre-proline 0 C--N 1.332 -0.189 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.546 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.78 93.57 0.32 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.48 2.12 . . . . 0.0 112.545 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.45 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 3.5 ptm -59.24 168.77 1.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.38 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.49 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -147.95 109.42 4.37 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.02 179.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.49 ' CD1' ' O ' ' A' ' 28' ' ' ALA . 2.8 p-90 38.58 -159.1 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.277 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.486 ' CG2' ' CE2' ' A' ' 29' ' ' TRP . 2.1 p 51.73 -179.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.864 0.364 . . . . 0.0 111.294 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.2 p90 -154.69 179.59 8.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.733 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 41.1 t -90.29 -72.72 0.55 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.797 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -178.61 -39.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.711 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -107.5 147.91 29.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.775 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.3 mmp_? -67.98 -8.79 40.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.983 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -89.82 -22.2 22.21 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.003 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -123.45 144.04 49.76 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.803 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -122.09 157.11 32.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.185 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 16.9 t -85.53 117.41 24.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.547 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.45 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.6 OUTLIER -96.57 176.6 5.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.328 -179.544 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.93 105.2 2.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.965 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 1.7 p90 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.224 -0.893 . . . . 0.0 112.084 -179.592 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' MET . . . . . 0.422 ' HB3' ' CD2' ' A' ' 31' ' ' TYR . 6.0 mmt . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.878 0.37 . . . . 0.0 110.974 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.405 ' HB2' ' O ' ' A' ' 6' ' ' MET . 6.3 tp60 177.76 159.63 0.47 Allowed 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.771 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.6 147.33 32.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.048 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 15.1 p -95.08 18.61 11.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.216 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 20.4 m0 -57.33 -42.93 82.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.818 0.342 . . . . 0.0 111.013 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.38 -20.36 22.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.278 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -95.39 23.26 6.07 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.267 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.6 m 57.78 -168.46 0.12 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.033 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 116.72 156.84 10.74 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.304 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.472 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 34.4 t -112.64 85.93 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.965 0.412 . . . . 0.0 111.07 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 46.4 t -57.56 100.64 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.178 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -119.27 -159.72 0.78 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.468 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -84.88 144.27 28.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.912 0.386 . . . . 0.0 110.967 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.6 mmtm -49.09 -27.35 3.31 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.244 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.41 ' O ' ' CD ' ' A' ' 22' ' ' ARG . 12.4 t -94.1 29.77 2.06 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.743 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.58 114.28 2.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.987 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.41 ' CD ' ' O ' ' A' ' 20' ' ' SER . 0.0 OUTLIER -115.64 19.15 15.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.194 179.839 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -123.38 -32.12 3.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.705 0.288 . . . . 0.0 111.392 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.7 -171.3 3.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.828 0.347 . . . . 0.0 110.893 -179.623 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.3 mtpt -98.33 167.69 11.12 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.93 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -66.9 123.16 10.64 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.535 2.156 . . . . 0.0 112.311 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.5 153.66 15.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.002 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -130.94 102.23 5.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.919 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.45 ' CE2' ' OG1' ' A' ' 30' ' ' THR . 0.0 OUTLIER 54.28 173.29 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.814 -179.858 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.45 ' OG1' ' CE2' ' A' ' 29' ' ' TRP . 0.2 OUTLIER 67.02 162.9 0.18 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.549 -179.459 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.422 ' CD2' ' HB3' ' A' ' 6' ' ' MET . 8.0 p90 -135.56 169.63 17.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.965 0.412 . . . . 0.0 110.948 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 41.1 t -89.92 -64.14 1.18 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.782 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -178.38 -49.16 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.643 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -106.75 148.61 28.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.684 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -69.25 -7.34 35.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.927 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -89.95 -19.31 24.65 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.112 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 9.5 mp0 -109.8 148.24 31.83 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.833 0.349 . . . . 0.0 111.03 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.5 132.4 53.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.857 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.6 t -77.87 97.3 5.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.992 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.472 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -57.47 154.26 11.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.761 179.85 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -57.96 110.0 0.84 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.995 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 13.9 p90 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.231 -0.89 . . . . 0.0 112.045 -179.706 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 3.9 mtp . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.926 0.393 . . . . 0.0 110.994 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 65.61 -176.16 0.18 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.837 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.425 ' HB1' ' CD1' ' A' ' 10' ' ' TRP . . . -96.71 -179.55 4.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.202 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.5 p -114.47 26.24 10.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.942 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.425 ' CD1' ' HB1' ' A' ' 8' ' ' ALA . 14.8 m95 -55.91 -47.63 77.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.078 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 47.4 t -98.23 30.96 2.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.94 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -145.49 29.43 1.14 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.806 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.8 m 58.35 -176.12 0.08 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.933 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 110.97 156.5 14.36 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.485 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.9 t -122.07 114.84 44.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.868 0.366 . . . . 0.0 111.135 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 37.5 t -70.08 87.03 0.56 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.954 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.75 -161.84 0.77 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.538 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -83.71 140.59 32.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.835 0.35 . . . . 0.0 110.827 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.47 -33.64 14.81 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.109 0.48 . . . . 0.0 111.075 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.6 t -100.33 27.0 6.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.943 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -57.37 113.75 1.9 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.987 0.422 . . . . 0.0 110.671 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.62 23.83 7.37 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.403 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -138.73 8.37 2.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.603 -0.272 . . . . 0.0 111.706 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -131.53 167.11 19.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.587 0.232 . . . . 0.0 110.809 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 18.0 mmtt -81.13 161.1 63.99 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 120.778 0.323 . . . . 0.0 110.96 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -57.86 124.26 15.58 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.624 2.216 . . . . 0.0 112.436 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -57.68 164.14 2.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.228 -179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.457 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -125.37 98.58 5.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.636 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.505 ' CE2' ' CG2' ' A' ' 30' ' ' THR . 7.0 p-90 36.87 -159.7 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.068 -0.514 . . . . 0.0 112.035 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.505 ' CG2' ' CE2' ' A' ' 29' ' ' TRP . 2.5 p 61.82 174.79 0.12 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.687 0.28 . . . . 0.0 110.406 -179.007 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 5.9 p90 -141.56 152.49 44.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.949 0.404 . . . . 0.0 111.122 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.3 t -89.85 -56.09 3.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.777 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -176.23 -46.38 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.563 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -109.4 151.53 26.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.639 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -67.58 -10.17 49.52 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 120.861 0.362 . . . . 0.0 111.789 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -91.17 -21.45 21.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.072 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -89.56 146.72 24.39 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.778 0.323 . . . . 0.0 111.069 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 8.0 ptpt -125.42 149.44 48.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.997 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 41.8 t -91.78 76.07 5.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.8 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 12.7 t -43.9 157.65 0.05 Allowed 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.388 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -95.46 102.09 13.86 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.822 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.227 -0.892 . . . . 0.0 112.297 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' MET . . . . . 0.41 ' O ' ' HB2' ' A' ' 7' ' ' GLN . 35.4 mtp . . . . . 0 C--O 1.23 0.065 0 CA-C-O 120.754 0.312 . . . . 0.0 110.903 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.416 ' N ' ' CE2' ' A' ' 31' ' ' TYR . 15.9 tt0 177.36 155.93 0.31 Allowed 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.788 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.46 161.34 9.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.179 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 3.8 p -120.16 10.27 11.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.213 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 16.9 m0 -54.59 -47.49 73.27 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.894 0.378 . . . . 0.0 111.103 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.68 31.12 6.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.837 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -138.29 38.9 2.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.906 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 52.0 m 61.95 115.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.936 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 156.97 149.17 5.32 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.531 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.8 t -126.58 94.86 2.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.893 0.378 . . . . 0.0 111.186 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 51.0 t -58.32 105.69 0.31 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.019 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.96 -166.54 1.18 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.809 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -89.07 133.48 34.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.887 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.34 -30.35 68.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.002 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 46.5 t -91.75 16.96 9.67 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.345 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -100.55 -42.51 6.53 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.732 0.301 . . . . 0.0 110.95 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 40.49 41.09 1.0 Allowed 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.869 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -110.94 13.57 22.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.13 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.4 t -132.43 178.64 6.67 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.788 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.16 168.44 11.28 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.781 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -69.4 119.31 6.29 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.531 2.154 . . . . 0.0 112.505 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.408 ' HG2' ' N ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -50.21 142.53 9.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.173 179.895 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.469 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -117.54 102.72 9.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.691 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.469 ' CD1' ' O ' ' A' ' 28' ' ' ALA . 5.9 p-90 36.79 -158.15 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.965 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.464 ' CG2' ' CE2' ' A' ' 29' ' ' TRP . 3.0 p 64.76 176.86 0.19 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.74 0.305 . . . . 0.0 110.59 -179.213 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.416 ' CE2' ' N ' ' A' ' 7' ' ' GLN . 6.7 p90 -140.39 153.13 46.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.07 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 38.0 t -97.84 -72.01 0.66 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.726 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -176.83 -48.82 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.751 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -103.19 138.13 40.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.752 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.4 mmp_? -68.52 -6.99 28.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.792 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -98.18 12.92 33.01 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.186 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 63.2 mm-40 -126.87 162.12 26.67 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.866 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -133.22 129.2 37.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.961 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.7 t -76.91 89.89 3.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.038 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.4 t -46.2 156.0 0.18 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.12 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -123.66 56.32 1.22 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.931 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 2.3 p90 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.22 -0.895 . . . . 0.0 112.095 -179.505 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.1 mtp . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.743 0.306 . . . . 0.0 111.015 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 166.8 170.58 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.726 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.454 ' CB ' ' CD1' ' A' ' 10' ' ' TRP . . . -59.69 151.35 25.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.061 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 27.6 p -96.96 23.95 6.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.259 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.454 ' CD1' ' CB ' ' A' ' 8' ' ' ALA . 15.8 m95 -55.89 -36.22 67.41 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.865 0.364 . . . . 0.0 110.971 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 t -89.99 -44.33 9.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.793 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.62 -27.77 69.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.89 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.1 p 63.8 137.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.017 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -169.47 -159.24 14.73 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.271 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.416 ' O ' ' HB2' ' A' ' 40' ' ' CYS . 25.1 t -128.23 83.87 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.951 0.405 . . . . 0.0 111.212 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.4 t -58.8 95.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.934 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.02 -161.89 0.99 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.812 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.74 137.64 33.65 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.889 0.375 . . . . 0.0 110.832 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -50.71 -27.33 6.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.057 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.1 t -99.56 27.06 5.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.1 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.41 ' HB3' ' HB2' ' A' ' 24' ' ' CYS . 21.7 tp10 -60.4 118.5 6.54 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 121.012 0.434 . . . . 0.0 110.383 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.61 13.1 14.87 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.79 -179.154 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -150.26 43.96 0.87 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.904 0.383 . . . . 0.0 110.519 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.41 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 0.1 OUTLIER -116.63 -178.58 3.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.587 -178.983 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.72 166.7 15.68 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.602 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.02 109.23 2.84 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.58 2.187 . . . . 0.0 112.714 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.446 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -75.3 171.81 13.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.329 179.825 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.487 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -127.47 110.02 12.34 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.496 179.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.487 ' CD1' ' O ' ' A' ' 28' ' ' ALA . 2.2 p-90 41.91 -167.43 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.869 -179.587 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.439 HG21 ' CZ3' ' A' ' 29' ' ' TRP . 0.2 OUTLIER 56.61 167.44 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.749 -179.231 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 46.7 p90 -140.24 179.17 6.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.926 0.394 . . . . 0.0 111.201 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 30.9 t -89.94 -71.45 0.61 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.691 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -179.47 -56.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.68 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 31.4 t-20 -90.27 141.82 28.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.658 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.3 mmp_? -68.16 -7.3 28.86 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.277 -0.419 . . . . 0.0 112.022 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -89.71 -22.74 22.07 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.801 179.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -124.7 139.15 54.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.685 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.67 143.7 45.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.054 -179.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 8.2 t -75.9 105.0 6.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.611 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.446 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.3 OUTLIER -72.76 177.74 4.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.23 -179.817 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.94 118.8 22.02 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.913 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 27.5 p90 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.239 -0.886 . . . . 0.0 112.129 -179.559 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 6.8 mtt . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.746 0.308 . . . . 0.0 110.945 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 167.92 158.26 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.732 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.413 ' HB1' ' CD1' ' A' ' 10' ' ' TRP . . . -62.56 166.65 5.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.103 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 31.8 p -103.55 18.27 22.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.244 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.413 ' CD1' ' HB1' ' A' ' 8' ' ' ALA . 8.7 m95 -57.41 -31.99 66.41 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.865 0.364 . . . . 0.0 111.135 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 t -89.86 -42.2 11.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.872 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -68.43 -25.33 64.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.945 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.6 t 64.47 118.21 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.926 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -153.23 -157.57 8.12 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.456 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 31.1 t -128.15 94.07 2.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.809 0.338 . . . . 0.0 111.072 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.1 t -72.86 96.7 2.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.723 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.61 -162.21 0.86 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.666 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -77.72 137.1 38.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.762 0.315 . . . . 0.0 110.811 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -48.43 -28.4 3.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.143 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.5 t -96.89 29.89 2.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.802 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -57.9 118.76 5.69 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.735 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -83.28 7.48 16.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.786 -179.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -146.54 40.69 1.11 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.962 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.25 154.22 19.43 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.554 -178.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.8 mttt -107.85 158.79 32.57 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.774 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -67.78 90.86 0.36 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.546 2.164 . . . . 0.0 112.631 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.441 ' HB2' ' HA ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -70.3 168.8 15.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.286 179.757 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.483 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -118.15 106.12 12.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.138 179.451 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.483 ' CD1' ' O ' ' A' ' 28' ' ' ALA . 10.0 p-90 38.4 -160.11 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.907 -179.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.481 ' CG2' ' CE2' ' A' ' 29' ' ' TRP . 2.7 p 64.89 169.12 0.19 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.737 0.303 . . . . 0.0 110.555 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 38.1 p90 -141.81 174.66 10.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.026 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 35.4 t -89.9 -78.03 0.38 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.833 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 179.92 -54.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.707 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -89.9 139.66 30.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.786 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -67.96 -8.09 34.18 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.806 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 44.0 t-20 -89.98 -22.83 21.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.925 179.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 13.4 mp0 -127.69 147.23 50.38 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.775 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.14 149.06 50.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.177 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.5 t -80.06 127.4 32.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.681 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.441 ' HA ' ' HB2' ' A' ' 27' ' ' MET . 0.1 OUTLIER -112.27 169.55 8.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.192 -179.727 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -57.67 129.24 40.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.053 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 21.0 p90 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.208 -0.901 . . . . 0.0 112.073 -179.583 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 12.9 mtt . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.764 0.316 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 168.88 -172.99 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.9 179.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.416 ' HB3' ' CD1' ' A' ' 10' ' ' TRP . . . -95.52 162.74 13.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.157 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.2 p -105.74 25.0 11.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.163 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.416 ' CD1' ' HB3' ' A' ' 8' ' ' ALA . 11.1 m95 -55.77 -39.2 70.89 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.879 0.371 . . . . 0.0 111.08 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.5 t -119.12 35.13 4.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.889 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -133.91 28.58 3.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.975 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.1 m 57.79 -175.48 0.07 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.997 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.01 163.45 24.86 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.462 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.1 t -118.2 96.91 4.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.907 0.385 . . . . 0.0 111.109 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 39.9 t -69.78 91.31 0.63 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.886 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.49 -167.04 1.33 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.507 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -111.13 74.75 0.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.868 0.366 . . . . 0.0 110.486 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.8 35.27 11.28 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.182 0.515 . . . . 0.0 109.97 -179.351 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.4 t -88.7 25.49 1.73 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.995 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -67.19 -1.95 5.1 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.625 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.97 10.45 11.78 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-O 120.787 0.327 . . . . 0.0 111.637 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.13 -23.96 0.25 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.309 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.01 -178.02 4.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.807 0.337 . . . . 0.0 111.032 -179.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.1 mmmt -87.28 164.07 37.16 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.848 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -60.35 119.67 6.99 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.657 2.238 . . . . 0.0 112.454 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 6.8 ptt? -55.59 169.47 0.32 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.022 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -103.87 179.0 4.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.73 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.429 ' CZ2' ' CG2' ' A' ' 30' ' ' THR . 45.9 p-90 -49.24 -44.67 43.77 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.315 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.429 ' CG2' ' CZ2' ' A' ' 29' ' ' TRP . 74.5 p -58.88 156.43 11.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 9.7 p90 -133.14 -179.23 5.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.926 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.04 -71.73 0.67 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.995 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -178.49 -48.89 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.765 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -89.9 139.55 30.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.918 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -66.13 -11.23 47.81 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.73 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -91.98 -24.03 19.36 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.043 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -97.72 135.69 39.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.833 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.64 143.37 47.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.041 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.3 t -91.31 89.02 7.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.967 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.8 t -50.44 153.86 1.45 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.04 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -102.68 95.2 6.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.828 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 6.2 p90 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.221 -0.895 . . . . 0.0 112.226 -179.564 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 37.8 mmm . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.809 0.338 . . . . 0.0 111.008 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 169.33 -169.98 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.747 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.41 156.14 37.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.107 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.5 p -95.55 22.73 6.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.106 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 15.5 m0 -59.39 -25.46 64.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.302 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.4 t -89.96 -33.53 16.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.995 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -83.76 -25.12 30.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.051 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.4 m 65.82 122.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.945 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -154.22 -161.37 10.41 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.339 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.406 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 29.2 t -116.14 87.09 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.884 0.373 . . . . 0.0 111.103 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.6 t -57.22 91.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.108 -179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.6 ttt85 -107.27 -158.64 0.66 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.565 179.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -93.02 146.79 23.37 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.825 0.345 . . . . 0.0 110.977 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.37 -26.81 8.41 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.03 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.439 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 33.3 t -97.95 32.72 2.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.459 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -61.45 117.07 5.22 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.178 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.439 ' HG3' ' O ' ' A' ' 20' ' ' SER . 0.0 OUTLIER -119.41 16.61 13.01 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.346 179.757 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -125.64 -26.51 3.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.662 0.268 . . . . 0.0 111.568 -179.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.71 -176.43 4.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.954 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.49 161.79 38.55 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.94 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -64.42 115.22 3.06 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.502 2.135 . . . . 0.0 112.18 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.79 156.22 11.57 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.067 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.473 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -127.89 105.26 8.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.511 179.64 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.473 ' CD1' ' O ' ' A' ' 28' ' ' ALA . 1.1 p-90 48.32 -179.74 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.344 -179.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.431 ' OG1' ' CE2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER 59.74 167.72 0.07 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.615 -179.308 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 5.6 p90 -144.09 178.31 7.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.146 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 38.6 t -89.89 -65.82 0.98 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.814 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -174.12 -55.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.713 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -91.44 149.87 21.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.694 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -68.6 -9.61 50.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.752 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -91.67 -18.89 23.3 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.223 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -106.26 150.99 25.38 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.853 0.359 . . . . 0.0 111.012 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -131.77 137.3 48.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.901 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.3 t -76.63 92.19 3.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.07 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.406 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 0.0 OUTLIER -58.72 156.55 10.84 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.571 179.831 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -58.06 124.04 17.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.029 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 15.3 p90 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.228 -0.891 . . . . 0.0 112.106 -179.638 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 49.7 mtp . . . . . 0 N--CA 1.457 -0.109 0 CA-C-O 120.854 0.359 . . . . 0.0 111.015 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 175.24 -167.61 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.661 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -112.23 176.23 5.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.215 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.5 p -114.43 28.81 8.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.075 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 8.3 m0 -52.67 -28.49 21.88 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.076 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 40.6 t -138.0 34.54 2.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.839 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -120.82 15.61 11.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.263 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 62.52 124.59 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.856 0.36 . . . . 0.0 111.058 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 162.11 164.83 17.9 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.474 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.422 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 1.5 t -112.96 106.04 19.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.854 0.359 . . . . 0.0 111.243 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 46.2 t -81.45 101.08 9.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.944 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.2 ttt85 -144.44 -161.59 1.31 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.756 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -70.65 139.87 51.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.907 0.384 . . . . 0.0 110.87 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.446 ' HA ' ' HG2' ' A' ' 38' ' ' LYS . 25.4 mtpt -79.33 -55.23 5.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.895 -179.368 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.7 t -82.3 7.97 12.5 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.936 -179.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -107.67 -72.74 0.71 Allowed 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 120.722 0.296 . . . . 0.0 111.541 -179.575 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.22 156.75 33.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.046 0.451 . . . . 0.0 111.8 -179.341 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -115.82 56.49 0.77 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.155 179.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.72 -175.11 4.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.016 -179.461 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.56 167.75 5.15 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.595 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -76.24 105.74 2.13 Favored 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.415 2.077 . . . . 0.0 112.554 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 14.5 ptt? -45.75 167.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.056 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -117.1 -177.54 3.23 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.024 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 56.0 p-90 -43.2 -39.24 2.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.354 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 32.4 p -60.18 146.74 42.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.589 179.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -137.71 177.96 7.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.926 0.393 . . . . 0.0 111.233 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.19 -70.47 0.7 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.794 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -170.74 -39.16 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.626 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -108.38 144.52 35.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.528 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -69.13 -7.75 39.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.303 -0.408 . . . . 0.0 112.002 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -89.84 2.84 54.47 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.38 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -127.23 141.4 51.74 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.742 0.306 . . . . 0.0 110.894 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.446 ' HG2' ' HA ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -116.13 155.36 28.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.079 -179.843 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 11.9 t -104.28 85.0 2.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.389 179.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.422 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 5.0 t -42.81 136.27 2.68 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.215 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -86.65 112.73 21.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.897 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.174 -0.917 . . . . 0.0 112.358 -179.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 7.6 mtt . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.786 0.327 . . . . 0.0 110.894 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 173.38 169.83 0.16 Allowed 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.831 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.426 ' HB3' ' CD1' ' A' ' 10' ' ' TRP . . . -72.92 164.53 26.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.141 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 26.5 p -109.5 22.21 16.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.131 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.426 ' CD1' ' HB3' ' A' ' 8' ' ' ALA . 6.3 m95 -57.31 -51.23 70.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.963 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 21.7 t -89.93 7.89 35.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.333 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -111.54 -22.48 11.23 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.754 0.312 . . . . 0.0 111.161 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 66.65 146.37 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.952 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -179.91 -149.62 8.64 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.421 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.7 t -142.73 87.66 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.804 0.335 . . . . 0.0 111.0 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 48.0 t -66.42 94.35 0.27 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.652 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.04 -171.5 2.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.674 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.431 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 2.2 m-20 -72.81 135.45 45.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.848 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.08 -37.27 76.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.953 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.1 t -101.95 33.12 3.15 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.893 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.431 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 0.9 OUTLIER -75.06 -174.51 2.29 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.095 179.768 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -123.38 17.4 9.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.507 -179.478 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.08 37.34 0.7 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.833 0.349 . . . . 0.0 110.819 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -95.47 133.18 39.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.087 -179.655 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.402 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 9.5 mmtp -93.32 158.64 36.74 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.854 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' A' ' 25' ' ' LYS . 5.9 Cg_endo -48.04 90.89 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.681 2.254 . . . . 0.0 112.337 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.0 ppp? -54.67 165.4 0.6 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.432 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.465 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -134.81 93.45 3.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.652 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.47 ' CE2' ' CG2' ' A' ' 30' ' ' THR . 9.5 p-90 37.29 -158.96 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.889 -179.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.47 ' CG2' ' CE2' ' A' ' 29' ' ' TRP . 1.7 p 62.78 -177.02 0.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.793 0.33 . . . . 0.0 110.607 -179.104 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -152.65 160.62 43.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.916 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 41.0 t -89.99 -71.74 0.6 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.815 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -165.42 -68.98 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.899 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -90.04 153.61 20.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.82 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -68.41 -8.57 41.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.991 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -89.87 -20.92 22.84 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.053 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -122.81 128.55 50.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.809 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -117.24 150.96 37.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.146 -179.82 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.2 t -80.85 83.33 6.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.552 179.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -66.55 176.83 1.75 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.089 -179.696 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -63.72 118.87 8.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.015 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 2.8 p90 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.229 -0.891 . . . . 0.0 112.062 -179.585 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.6 mtp . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.801 0.334 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 177.72 175.8 0.45 Allowed 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.938 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.437 ' CB ' ' CE3' ' A' ' 10' ' ' TRP . . . -81.77 172.58 13.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.267 -179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.5 p -111.19 23.4 14.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.996 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.437 ' CE3' ' CB ' ' A' ' 8' ' ' ALA . 5.9 m0 -58.3 -19.9 38.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.411 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.8 t -89.71 -51.58 5.44 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.821 0.343 . . . . 0.0 111.227 -179.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -88.82 8.69 27.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.566 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 52.5 -168.04 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.819 0.342 . . . . 0.0 111.077 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 152.11 -166.4 31.0 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.531 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.4 t -119.7 92.63 2.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.814 0.34 . . . . 0.0 111.033 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 51.2 t -74.27 101.88 4.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.965 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.64 -163.89 1.44 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.763 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -78.0 136.92 38.04 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.865 0.364 . . . . 0.0 110.955 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.7 mttt -58.48 -27.08 64.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.978 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.6 t -107.09 35.6 2.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.738 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -74.61 168.79 19.09 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 121.132 0.491 . . . . 0.0 110.407 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.08 16.14 16.04 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.492 -179.547 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -150.2 31.51 0.68 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.882 0.372 . . . . 0.0 110.648 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.7 146.65 23.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.115 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.421 ' CB ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -95.96 167.21 12.91 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.81 179.962 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.421 ' HD2' ' CB ' ' A' ' 25' ' ' LYS . 9.5 Cg_endo -50.8 87.82 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.66 2.24 . . . . 0.0 112.417 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.405 ' N ' ' O ' ' A' ' 25' ' ' LYS . 5.4 ppp? -60.48 166.43 3.13 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.207 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -123.3 177.08 5.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.948 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.424 ' CZ2' HG21 ' A' ' 30' ' ' THR . 63.4 p-90 -48.08 -28.85 3.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.248 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.424 HG21 ' CZ2' ' A' ' 29' ' ' TRP . 26.6 p -67.88 148.94 50.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.857 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 41.5 p90 -136.21 -177.53 4.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.907 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.81 -70.87 0.64 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.908 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 179.16 -44.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.766 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -90.06 144.04 26.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.863 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -67.21 -10.92 55.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.839 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -89.97 -21.97 22.16 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.139 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 71.2 mm-40 -123.72 143.14 50.46 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.942 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -130.31 160.79 32.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.001 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.8 t -93.37 106.07 18.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.711 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 m -86.2 175.08 8.69 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.958 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -63.56 115.87 5.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.947 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 38.3 p90 . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.214 -0.898 . . . . 0.0 112.144 -179.529 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.3 mtt . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.643 0.259 . . . . 0.0 110.745 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 175.11 151.64 0.11 Allowed 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 120.828 0.346 . . . . 0.0 110.904 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.93 165.95 8.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.194 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 11.8 p -102.32 28.02 6.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.889 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 18.7 m0 -56.03 -28.78 58.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.203 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.2 t -89.97 -64.4 1.14 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.018 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 64.9 t-80 -57.07 -28.67 62.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.038 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.8 p 62.78 121.54 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.012 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -135.48 -133.27 3.23 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.467 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.5 t -144.22 85.52 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.758 0.314 . . . . 0.0 111.236 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.1 t -70.07 96.56 1.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.736 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.54 -162.92 1.18 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.745 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.37 132.79 38.73 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.95 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -50.8 -29.54 11.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.972 0.415 . . . . 0.0 110.876 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.0 t -104.22 32.39 4.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.979 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -67.68 140.42 56.8 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.338 0.59 . . . . 0.0 110.295 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.85 14.61 15.02 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.621 -179.294 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -150.35 34.47 0.64 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.822 0.344 . . . . 0.0 110.8 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -94.1 162.62 13.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.321 -179.498 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.411 ' CD ' ' HD2' ' A' ' 26' ' ' PRO . 22.5 mmtm -115.94 164.25 18.36 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.621 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.411 ' HD2' ' CD ' ' A' ' 25' ' ' LYS . 9.1 Cg_endo -50.69 90.25 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.571 2.181 . . . . 0.0 112.572 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -57.0 164.98 1.38 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.19 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -117.69 178.03 4.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.058 179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.42 ' CE2' HG22 ' A' ' 30' ' ' THR . 38.5 p-90 -48.07 -29.75 3.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.344 -179.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.42 HG22 ' CE2' ' A' ' 29' ' ' TRP . 29.1 p -58.3 150.41 22.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.034 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -127.18 176.69 7.19 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.916 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 25.7 t -103.31 -67.07 0.9 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.895 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.1 tp10 -178.77 -63.99 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.733 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 20.4 t30 -89.96 149.82 22.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.796 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.1 mmp_? -67.69 -8.45 35.21 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.079 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 36.4 t-20 -89.66 -23.11 21.97 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.805 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -120.04 130.5 54.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.487 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.91 145.57 47.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.307 -179.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.9 t -83.31 97.26 8.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.644 179.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -71.55 170.44 13.36 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.934 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.409 ' O ' ' C ' ' A' ' 42' ' ' TYR . 2.6 tt0 -93.72 116.9 29.41 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.188 -179.647 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.409 ' C ' ' O ' ' A' ' 41' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.261 -0.876 . . . . 0.0 112.449 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 7.0 mtt . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.76 0.314 . . . . 0.0 110.981 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 168.01 -171.34 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.79 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.415 ' HB2' ' CE1' ' A' ' 31' ' ' TYR . . . -85.17 174.24 9.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.986 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 12.1 m -97.19 21.71 9.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.12 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 9.1 m0 -56.85 -32.77 66.12 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.821 0.344 . . . . 0.0 111.016 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.3 t -97.69 -43.78 7.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.981 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.421 ' CD2' ' CG2' ' A' ' 30' ' ' THR . 37.2 m-70 -58.1 -31.6 67.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.947 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t 62.33 31.34 17.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.086 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.96 -164.27 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.217 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.467 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 1.1 t -116.74 94.44 3.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.938 0.399 . . . . 0.0 110.994 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.3 t -67.34 106.7 2.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.984 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.7 -158.65 0.65 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.657 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.27 142.41 27.44 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.838 0.351 . . . . 0.0 110.803 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.06 -37.54 69.42 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.889 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.6 t -74.94 -11.47 60.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.131 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -98.81 92.48 5.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.807 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.42 ' N ' ' CD ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -97.06 40.63 1.14 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.893 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.12 -26.84 20.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.968 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.98 177.87 6.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.789 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.53 144.12 92.76 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.747 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -88.18 95.41 0.4 Allowed 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.937 2.424 . . . . 0.0 112.8 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.424 ' HG2' ' NE1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -76.22 100.92 5.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.644 179.628 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -102.46 55.64 0.78 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.011 0.434 . . . . 0.0 111.657 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.436 ' CH2' HG22 ' A' ' 30' ' ' THR . 5.1 p-90 -168.1 -43.6 0.02 OUTLIER 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.481 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.436 HG22 ' CH2' ' A' ' 29' ' ' TRP . 7.7 p -101.33 168.87 9.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.703 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.415 ' CE1' ' HB2' ' A' ' 8' ' ' ALA . 23.2 p90 -140.09 166.06 25.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.191 -179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 35.7 t -89.92 -75.08 0.46 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.937 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -176.0 -46.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.786 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 33.0 t-20 -101.91 145.64 28.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.749 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -69.49 -8.67 48.97 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.868 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 -89.99 -17.22 28.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.145 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 9.2 mp0 -106.59 166.34 10.63 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.905 0.383 . . . . 0.0 110.872 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.02 113.97 8.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.732 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 9.1 t -59.34 136.89 58.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.943 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.467 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 13.3 t -97.97 136.23 38.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.677 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.82 89.69 4.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.938 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 30.0 p90 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.238 -0.887 . . . . 0.0 112.114 -179.603 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 2.8 mmm . . . . . 0 CA--C 1.531 0.225 0 CA-C-O 120.502 0.191 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -175.71 146.19 0.74 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 120.819 0.343 . . . . 0.0 110.825 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.417 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . . . -55.09 177.26 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.244 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.02 8.89 27.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.215 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.417 ' CD1' ' HB2' ' A' ' 8' ' ' ALA . 8.0 m95 -54.57 -29.84 52.49 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.816 0.341 . . . . 0.0 111.091 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.6 t -108.65 40.07 1.87 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.918 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -164.26 -51.25 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.863 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 61.64 100.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.897 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -119.6 -117.09 2.62 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.478 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.7 t -132.45 80.42 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.855 0.36 . . . . 0.0 111.15 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.3 t -72.49 89.54 1.27 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.639 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -140.49 -166.58 2.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.768 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.43 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 11.8 t70 -66.17 136.11 55.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.864 0.364 . . . . 0.0 110.695 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.8 mtmm -60.69 -29.54 69.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.736 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.6 t -107.66 35.77 2.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.605 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.43 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 0.5 OUTLIER -75.46 -164.5 0.34 Allowed 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.4 -179.982 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -118.99 18.16 13.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.695 0.283 . . . . 0.0 111.201 -179.758 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -148.18 35.7 0.82 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.876 0.37 . . . . 0.0 110.69 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -97.29 126.94 42.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.999 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.3 mtpp -113.08 163.56 17.76 Favored Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.964 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.74 91.67 0.09 OUTLIER 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.55 2.167 . . . . 0.0 112.58 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' MET . . . . . 0.453 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -77.97 171.72 14.57 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.175 0.512 . . . . 0.0 111.286 179.812 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.482 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -122.76 108.9 13.56 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.437 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.482 ' CD1' ' O ' ' A' ' 28' ' ' ALA . 9.3 p-90 37.49 -159.32 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.098 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.471 ' CG2' ' CE2' ' A' ' 29' ' ' TRP . 3.0 p 65.4 157.37 0.1 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.737 0.303 . . . . 0.0 110.592 -179.216 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 31.4 p90 -136.72 175.38 9.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.092 -179.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.7 t -98.38 -73.58 0.61 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.987 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -179.59 -51.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.868 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -90.0 136.7 32.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.881 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -69.74 -6.73 33.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.807 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -89.96 -19.21 24.76 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.879 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -131.22 141.53 50.05 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.892 0.377 . . . . 0.0 110.801 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.36 158.59 23.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.835 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 9.8 t -89.99 80.76 6.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.815 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.453 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.0 OUTLIER -65.3 171.23 3.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.779 179.955 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -63.86 120.72 12.45 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.061 -179.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 2.9 p90 . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.235 -0.888 . . . . 0.0 112.045 -179.721 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 3.5 pt . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.851 0.358 . . . . 0.0 111.129 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -132.0 29.65 4.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.926 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 20.6 p90 173.73 -35.94 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.872 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.36 85.26 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.841 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -44.12 -74.45 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.562 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 35.6 mtm -85.44 -165.02 1.1 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.787 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 172.57 172.45 0.11 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.793 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.36 176.44 0.25 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.133 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.2 p -111.11 29.68 7.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.969 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 9.3 m0 -54.55 -31.97 57.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.18 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.0 t -97.45 -57.92 2.13 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.987 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 21.3 t-80 -57.85 -26.8 62.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.054 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.97 163.46 0.1 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.935 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 164.88 174.46 34.63 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.556 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.5 t -91.94 105.66 16.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.854 0.359 . . . . 0.0 111.122 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.9 t -79.02 96.09 5.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.84 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.2 -164.3 1.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.888 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 77.1 m-20 -74.46 138.55 43.32 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.86 0.362 . . . . 0.0 111.214 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.403 ' HA ' ' HG2' ' A' ' 38' ' ' LYS . 0.7 OUTLIER -52.52 -29.25 24.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.2 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.0 t -103.87 33.45 3.42 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.002 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -65.44 133.99 52.48 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 121.287 0.565 . . . . 0.0 110.641 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.65 14.73 7.89 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.404 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.18 38.5 0.72 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.001 0.429 . . . . 0.0 110.39 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.98 154.51 19.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.17 -179.48 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.441 ' CB ' ' CD ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -105.54 179.08 0.98 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.876 -179.896 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.441 ' CD ' ' CB ' ' A' ' 25' ' ' LYS . 33.1 Cg_exo -59.91 80.22 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.514 2.143 . . . . 0.0 112.402 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.84 164.03 1.27 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.05 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -124.78 177.55 5.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.059 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.419 ' CE2' HG22 ' A' ' 30' ' ' THR . 65.7 p-90 -47.55 -29.91 3.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.397 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.419 HG22 ' CE2' ' A' ' 29' ' ' TRP . 20.0 p -65.48 151.99 45.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.907 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 28.4 p90 -137.06 -179.14 5.53 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.887 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.5 t -89.92 -66.29 0.94 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.828 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 178.53 -56.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.66 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -89.98 150.16 22.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.742 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -69.15 -8.03 41.73 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.933 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -89.76 -19.79 24.32 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.003 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 58.6 mm-40 -125.76 131.6 52.48 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.774 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.403 ' HG2' ' HA ' ' A' ' 19' ' ' LYS . 5.2 ptpt -117.3 153.56 32.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.154 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.9 t -96.33 94.63 7.56 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.609 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -76.9 177.19 7.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.082 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.81 115.94 11.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.886 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 15.6 p90 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.227 -0.892 . . . . 0.0 112.118 -179.671 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 1.6 pt . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.863 0.364 . . . . 0.0 111.101 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 40.9 mtp -150.97 138.22 19.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.889 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 4.2 t80 60.76 64.77 1.11 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.843 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -121.64 -40.32 2.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.925 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 56.27 95.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.864 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 3.5 mmt -101.54 175.16 5.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.869 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 175.99 170.72 0.39 Allowed 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.833 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.45 -172.93 0.38 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.049 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.2 p -117.1 24.85 10.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.993 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 7.8 m95 -57.36 -27.3 62.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.142 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.7 t -89.94 -32.88 16.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.969 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -80.03 -29.62 39.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.845 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.6 m 62.12 84.31 0.14 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.913 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -113.82 -145.39 9.1 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.837 -0.696 . . . . 0.0 112.477 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.4 t -131.13 102.65 6.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.822 0.344 . . . . 0.0 111.082 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.9 t -79.81 103.27 9.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.952 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.12 -165.48 1.37 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.66 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.457 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 9.0 t70 -71.27 136.53 47.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.962 0.411 . . . . 0.0 110.972 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.97 -36.35 27.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.027 0.441 . . . . 0.0 111.049 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.6 t -101.43 31.85 3.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.966 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.457 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 7.6 tp10 -61.94 129.95 43.33 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.214 0.531 . . . . 0.0 110.447 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.6 16.2 4.07 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.632 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -150.18 40.19 0.78 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.99 0.424 . . . . 0.0 110.374 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.85 147.79 23.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.215 -179.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.418 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 0.1 OUTLIER -98.2 172.08 5.2 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.638 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.418 ' HD2' ' HB3' ' A' ' 25' ' ' LYS . 45.3 Cg_exo -57.11 83.38 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.447 2.098 . . . . 0.0 112.541 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -54.67 168.19 0.3 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.253 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -120.26 173.17 7.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.867 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.445 ' CE2' HG22 ' A' ' 30' ' ' THR . 46.6 p-90 -47.07 -29.02 1.93 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.408 -179.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.445 HG22 ' CE2' ' A' ' 29' ' ' TRP . 44.3 p -65.33 165.1 12.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.087 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -135.39 -179.41 5.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.842 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 49.0 t -93.39 -78.65 0.42 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.007 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -179.49 -51.44 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.01 -179.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -89.87 144.27 26.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.888 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -66.75 -12.06 57.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.686 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -90.07 -22.63 21.72 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.126 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 -128.06 138.55 52.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.79 0.329 . . . . 0.0 111.059 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.28 158.36 31.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.043 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 33.9 t -90.52 113.67 25.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.957 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -98.51 179.45 4.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.788 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.9 127.26 30.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.786 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 29.0 p90 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.232 -0.889 . . . . 0.0 112.17 -179.555 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 11.3 pt . . . . . 0 N--CA 1.485 1.299 0 CA-C-O 120.866 0.365 . . . . 0.0 111.132 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 22.9 mtm -110.75 128.46 55.74 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.853 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 1.5 t80 177.93 -50.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.857 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -80.0 115.74 19.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.895 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -43.42 -51.55 6.49 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.542 -179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 8.8 mmm -78.91 179.59 7.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.894 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 168.42 155.03 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.795 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.405 ' HB1' ' CD1' ' A' ' 10' ' ' TRP . . . -59.81 166.67 2.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.021 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 29.3 p -105.09 20.06 19.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.25 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.405 ' CD1' ' HB1' ' A' ' 8' ' ' ALA . 14.6 m95 -57.52 -27.99 63.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.762 0.315 . . . . 0.0 111.092 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.9 t -90.09 -64.6 1.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.951 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.5 -23.93 59.22 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.154 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 66.21 147.85 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.931 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -171.35 -164.68 27.43 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.526 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.5 t -115.96 95.97 4.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.814 0.34 . . . . 0.0 111.148 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.4 t -72.02 95.84 1.65 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.778 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.4 -168.04 1.99 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.774 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -74.9 136.78 41.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.8 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.7 mttm -53.83 -28.06 33.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.918 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 29.3 t -105.31 34.53 3.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.739 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -73.22 149.29 42.95 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.297 0.57 . . . . 0.0 110.616 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -98.65 17.57 18.89 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.127 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -148.01 28.93 0.91 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.833 0.349 . . . . 0.0 110.682 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.35 147.47 23.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.995 -179.627 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.42 ' HB3' ' HB3' ' A' ' 41' ' ' GLU . 1.1 mptp? -101.07 177.54 1.49 Allowed Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.747 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.411 ' CD ' ' CB ' ' A' ' 25' ' ' LYS . 47.5 Cg_exo -56.67 82.86 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.434 2.089 . . . . 0.0 112.525 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.406 ' N ' ' O ' ' A' ' 25' ' ' LYS . 5.5 ppp? -52.82 164.42 0.38 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.299 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -124.49 174.53 7.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.051 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.408 ' CE2' HG23 ' A' ' 30' ' ' THR . 55.2 p-90 -49.16 -30.66 7.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.287 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.408 HG23 ' CE2' ' A' ' 29' ' ' TRP . 13.2 p -58.66 158.24 8.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.899 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -129.46 172.38 11.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.859 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 40.8 t -90.03 -73.78 0.51 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.937 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -179.13 -49.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.736 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -89.97 140.91 29.17 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.787 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -70.53 -6.98 40.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.946 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -89.91 -14.03 35.05 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.17 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.41 161.59 35.03 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.801 0.334 . . . . 0.0 110.787 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -130.54 162.53 29.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.113 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.6 t -99.91 104.77 16.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.86 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 m -81.31 176.87 9.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.737 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.42 ' HB3' ' HB3' ' A' ' 25' ' ' LYS . 0.3 OUTLIER -71.05 116.62 11.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.717 179.908 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 1.8 p90 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.245 -0.884 . . . . 0.0 112.198 -179.512 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 4.6 tp . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 120.748 0.308 . . . . 0.0 111.083 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.95 -42.23 5.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.884 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -179.89 -39.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.891 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -171.3 -58.09 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.864 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.407 ' O ' ' CE3' ' A' ' 29' ' ' TRP . 0.6 OUTLIER 177.83 88.58 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.73 179.662 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 72.3 mtp -102.26 152.23 21.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.16 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.451 ' N ' ' CE2' ' A' ' 31' ' ' TYR . 0.0 OUTLIER 174.58 157.62 0.16 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.723 179.728 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.79 156.81 10.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.235 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.6 p -115.1 25.8 10.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.966 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 11.8 m0 -55.45 -38.44 69.05 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.131 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -108.26 30.35 6.49 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.046 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -147.36 21.21 1.2 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.146 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 53.25 178.84 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.781 0.324 . . . . 0.0 111.025 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 145.42 171.79 15.32 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.615 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.4 t -120.19 85.12 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.837 0.351 . . . . 0.0 111.074 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.7 t -61.69 94.78 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.976 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.58 -163.63 0.92 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.624 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -88.59 137.73 32.06 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.738 0.304 . . . . 0.0 110.897 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.1 mtpp -50.86 -30.77 15.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.913 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.9 t -99.23 25.12 7.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.851 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.4 ' CG ' ' HB2' ' A' ' 24' ' ' CYS . 18.6 tp10 -60.51 118.26 6.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.087 0.47 . . . . 0.0 110.565 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.29 12.31 18.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.558 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -150.08 40.13 0.78 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.169 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.4 ' HB2' ' CG ' ' A' ' 21' ' ' GLU . 0.4 OUTLIER -98.84 179.17 4.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.609 -179.181 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.7 mmtt -115.18 164.69 16.13 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.289 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -50.52 90.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.483 2.122 . . . . 0.0 112.651 -179.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.413 ' CB ' ' HA ' ' A' ' 40' ' ' CYS . 0.1 OUTLIER -60.15 168.54 1.91 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.98 179.727 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -122.26 174.3 7.07 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.931 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.456 ' CD2' HG21 ' A' ' 30' ' ' THR . 37.5 p-90 -49.38 -26.76 3.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.451 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.456 HG21 ' CD2' ' A' ' 29' ' ' TRP . 15.7 p -66.94 157.92 32.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.85 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.451 ' CE2' ' N ' ' A' ' 7' ' ' GLN . 15.1 p90 -137.37 177.51 7.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.967 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 4.1 t -89.92 -67.37 0.85 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.986 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -179.45 -53.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.701 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 55.3 t30 -90.0 152.44 21.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.751 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -66.79 -11.55 55.52 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.824 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -90.01 -22.64 21.78 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.082 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -114.87 134.35 55.21 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.753 0.311 . . . . 0.0 110.992 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.63 154.82 37.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.121 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 9.0 t -87.5 99.28 11.91 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.589 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.413 ' HA ' ' CB ' ' A' ' 27' ' ' MET . 0.7 OUTLIER -79.83 174.84 11.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.302 -179.548 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -58.13 106.77 0.4 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.005 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 10.5 p90 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.235 -0.888 . . . . 0.0 112.053 -179.584 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 11.3 tt . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.895 0.379 . . . . 0.0 111.101 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.1 ptt? -140.8 -57.96 0.51 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.892 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -55.99 -171.94 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.22 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -154.39 142.87 20.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.839 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 54.68 69.68 0.7 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.081 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 30.6 mmm -101.56 -166.82 1.34 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.752 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 169.94 179.82 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.817 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.442 ' CB ' ' CE2' ' A' ' 10' ' ' TRP . . . -100.51 -177.21 3.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.133 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 27.3 p -109.89 27.77 9.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.0 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.442 ' CE2' ' CB ' ' A' ' 8' ' ' ALA . 9.7 m95 -54.49 -31.25 55.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.033 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.4 t -97.3 -52.2 3.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.849 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -59.62 -25.95 65.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.945 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.5 p 63.32 143.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.974 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -165.87 -134.48 1.68 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.5 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.8 t -141.06 82.02 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.859 0.362 . . . . 0.0 111.068 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.0 t -66.37 89.32 0.14 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.808 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.18 -166.26 1.2 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.738 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.66 136.23 41.92 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.825 0.345 . . . . 0.0 110.91 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.4 mttt -63.53 -34.95 78.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.653 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.1 t -104.79 34.76 3.02 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.41 179.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.85 -175.63 3.55 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.351 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -123.04 17.96 10.04 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.496 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.02 40.0 0.78 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.88 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -97.14 146.97 24.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.039 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.487 ' CB ' ' HD2' ' A' ' 26' ' ' PRO . 1.0 OUTLIER -106.15 170.83 5.37 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.763 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.487 ' HD2' ' CB ' ' A' ' 25' ' ' LYS . 9.5 Cg_endo -52.49 87.72 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.393 2.062 . . . . 0.0 112.246 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.402 ' N ' ' O ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -62.46 165.77 5.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.137 -179.902 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -115.13 177.69 4.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.012 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.413 ' CE2' HG22 ' A' ' 30' ' ' THR . 64.1 p-90 -49.97 -36.18 27.19 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.292 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.413 HG22 ' CE2' ' A' ' 29' ' ' TRP . 19.1 p -58.92 148.78 29.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.967 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 16.8 p90 -130.68 179.96 5.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.917 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.5 t -94.43 -69.5 0.75 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.892 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.4 pp20? 178.54 -46.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.862 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -96.66 146.87 24.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.862 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -69.14 -8.3 44.24 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.871 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -89.8 -19.28 24.88 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.059 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -129.39 141.12 51.14 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.812 0.339 . . . . 0.0 110.853 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -131.78 158.06 42.22 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.095 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 17.8 t -86.26 93.15 8.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.591 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -82.07 166.41 19.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.975 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.88 139.23 52.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.935 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.237 -0.887 . . . . 0.0 112.277 -179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 8.9 tp . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.787 0.327 . . . . 0.0 111.065 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 4.1 mmt -133.18 133.84 43.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.883 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 60.13 40.1 18.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.913 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -164.67 -163.34 0.72 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.876 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 179.28 98.21 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 120.893 0.377 . . . . 0.0 110.915 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 8.3 mtt -70.25 -173.19 0.66 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.88 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 178.05 -172.45 0.12 Allowed 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.924 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.59 157.29 35.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.254 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.5 p -107.89 25.45 11.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.97 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 18.1 m0 -55.99 -32.1 63.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.256 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.0 t -89.98 -34.3 16.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.962 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -70.0 -16.42 63.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.276 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 67.34 126.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.859 0.361 . . . . 0.0 110.929 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -172.87 -167.8 33.3 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.825 -0.703 . . . . 0.0 112.288 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.422 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 24.4 t -122.84 95.16 3.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.967 0.413 . . . . 0.0 111.166 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.7 t -62.51 86.25 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.894 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.38 -163.21 1.02 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.765 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -96.07 142.01 28.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.842 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.16 -40.69 90.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.894 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.7 t -73.42 -11.89 60.62 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.136 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -102.62 95.14 6.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.829 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.43 ' N ' ' CD ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -97.67 40.29 1.17 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.967 -179.794 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -98.35 24.76 6.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.96 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -121.69 -173.73 2.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.683 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.26 155.4 84.14 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.645 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -64.16 103.33 0.42 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.418 2.079 . . . . 0.0 112.328 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 12.6 ptm -60.81 163.62 5.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.129 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.437 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -134.41 104.76 6.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.824 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.437 ' CD1' ' O ' ' A' ' 28' ' ' ALA . 0.5 OUTLIER 47.75 -178.71 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.418 -179.815 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.427 ' OG1' ' CE2' ' A' ' 29' ' ' TRP . 0.2 OUTLIER 63.37 161.72 0.1 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.633 -179.461 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -139.32 -178.86 5.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.945 0.402 . . . . 0.0 111.229 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 36.1 t -89.84 -64.03 1.2 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.762 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -178.47 -44.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.679 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 60.5 t30 -107.89 150.49 26.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.663 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -69.85 -7.0 36.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.926 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -89.74 -17.83 27.51 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.965 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -119.13 149.34 41.87 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.817 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -121.52 162.43 20.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.952 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 15.4 t -95.82 83.21 3.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.825 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.422 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -55.7 154.04 7.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.668 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.65 107.99 5.43 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.059 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 28.4 p90 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.079 -179.6 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 1.2 tp . . . . . 0 N--CA 1.487 1.424 0 CA-C-O 120.815 0.341 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 6.9 mmt -126.16 146.53 49.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.898 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 5.8 t80 60.34 79.13 0.25 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.895 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -112.27 151.0 30.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.931 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -43.28 -32.98 0.88 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.42 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 40.2 mtt -75.73 -174.36 2.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.869 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 175.53 160.41 0.25 Allowed 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.918 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.37 153.66 40.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.184 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.5 p -113.81 19.6 16.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.18 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 50.3 m0 -56.51 -44.74 81.04 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.831 0.348 . . . . 0.0 111.082 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.85 -20.21 23.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.239 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 13.0 m-70 -96.18 24.28 5.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.069 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.0 t 56.95 179.95 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.989 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 139.24 166.0 10.45 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.476 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.2 t -116.1 87.86 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.868 0.366 . . . . 0.0 111.17 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 49.5 t -67.05 99.69 0.68 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.939 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.51 -164.65 1.12 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.603 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -83.1 138.3 33.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.824 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.1 mttm -49.76 -29.81 8.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.949 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.8 t -103.4 28.17 6.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.711 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 -60.63 117.52 5.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.715 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.76 12.92 13.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.446 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -149.29 42.67 0.93 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.204 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -104.21 173.18 6.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.479 -179.112 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -104.34 168.13 8.98 Favored Pre-proline 0 C--N 1.332 -0.189 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.546 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.78 93.57 0.32 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.48 2.12 . . . . 0.0 112.545 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.45 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 3.5 ptm -59.24 168.77 1.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.38 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.49 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -147.95 109.42 4.37 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.02 179.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.49 ' CD1' ' O ' ' A' ' 28' ' ' ALA . 2.8 p-90 38.58 -159.1 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.277 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.486 ' CG2' ' CE2' ' A' ' 29' ' ' TRP . 2.1 p 51.73 -179.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.864 0.364 . . . . 0.0 111.294 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.2 p90 -154.69 179.59 8.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.733 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 41.1 t -90.29 -72.72 0.55 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.797 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -178.61 -39.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.711 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -107.5 147.91 29.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.775 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.3 mmp_? -67.98 -8.79 40.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.983 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -89.82 -22.2 22.21 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.003 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -123.45 144.04 49.76 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.803 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -122.09 157.11 32.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.185 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 16.9 t -85.53 117.41 24.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.547 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.45 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.6 OUTLIER -96.57 176.6 5.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.328 -179.544 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.93 105.2 2.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.965 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 1.7 p90 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.224 -0.893 . . . . 0.0 112.084 -179.592 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 2.6 pt . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.786 0.327 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -176.7 149.48 0.76 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.927 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 63.15 145.41 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.885 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -167.57 83.08 0.21 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.858 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -43.44 -34.64 1.36 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.561 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.422 ' HB3' ' CD2' ' A' ' 31' ' ' TYR . 6.0 mmt -83.38 -178.36 7.04 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.974 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.405 ' HB2' ' O ' ' A' ' 6' ' ' MET . 6.3 tp60 177.76 159.63 0.47 Allowed 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.771 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.6 147.33 32.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.048 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 15.1 p -95.08 18.61 11.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.216 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 20.4 m0 -57.33 -42.93 82.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.818 0.342 . . . . 0.0 111.013 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.38 -20.36 22.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.278 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -95.39 23.26 6.07 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.267 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.6 m 57.78 -168.46 0.12 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.033 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 116.72 156.84 10.74 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.304 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.472 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 34.4 t -112.64 85.93 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.965 0.412 . . . . 0.0 111.07 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 46.4 t -57.56 100.64 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.178 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -119.27 -159.72 0.78 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.468 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -84.88 144.27 28.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.912 0.386 . . . . 0.0 110.967 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.6 mmtm -49.09 -27.35 3.31 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.244 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.41 ' O ' ' CD ' ' A' ' 22' ' ' ARG . 12.4 t -94.1 29.77 2.06 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.743 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.58 114.28 2.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.987 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.41 ' CD ' ' O ' ' A' ' 20' ' ' SER . 0.0 OUTLIER -115.64 19.15 15.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.194 179.839 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -123.38 -32.12 3.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.705 0.288 . . . . 0.0 111.392 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.7 -171.3 3.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.828 0.347 . . . . 0.0 110.893 -179.623 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.3 mtpt -98.33 167.69 11.12 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.93 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -66.9 123.16 10.64 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.535 2.156 . . . . 0.0 112.311 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.5 153.66 15.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.002 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -130.94 102.23 5.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.919 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.45 ' CE2' ' OG1' ' A' ' 30' ' ' THR . 0.0 OUTLIER 54.28 173.29 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.814 -179.858 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.45 ' OG1' ' CE2' ' A' ' 29' ' ' TRP . 0.2 OUTLIER 67.02 162.9 0.18 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.549 -179.459 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.422 ' CD2' ' HB3' ' A' ' 6' ' ' MET . 8.0 p90 -135.56 169.63 17.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.965 0.412 . . . . 0.0 110.948 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 41.1 t -89.92 -64.14 1.18 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.782 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -178.38 -49.16 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.643 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -106.75 148.61 28.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.684 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -69.25 -7.34 35.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.927 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -89.95 -19.31 24.65 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.112 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 9.5 mp0 -109.8 148.24 31.83 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.833 0.349 . . . . 0.0 111.03 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.5 132.4 53.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.857 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.6 t -77.87 97.3 5.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.992 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.472 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -57.47 154.26 11.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.761 179.85 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -57.96 110.0 0.84 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.995 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 13.9 p90 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.231 -0.89 . . . . 0.0 112.045 -179.706 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 30.1 mm . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.832 0.348 . . . . 0.0 111.079 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.95 -64.93 1.18 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.804 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 16.7 t80 60.81 88.15 0.08 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.944 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -105.12 115.23 29.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.853 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -43.58 -56.57 3.62 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.614 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 3.9 mtp -156.33 -68.32 0.11 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.994 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 65.61 -176.16 0.18 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.837 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.425 ' HB1' ' CD1' ' A' ' 10' ' ' TRP . . . -96.71 -179.55 4.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.202 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.5 p -114.47 26.24 10.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.942 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.425 ' CD1' ' HB1' ' A' ' 8' ' ' ALA . 14.8 m95 -55.91 -47.63 77.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.078 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 47.4 t -98.23 30.96 2.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.94 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -145.49 29.43 1.14 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.806 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.8 m 58.35 -176.12 0.08 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.933 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 110.97 156.5 14.36 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.485 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.9 t -122.07 114.84 44.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.868 0.366 . . . . 0.0 111.135 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 37.5 t -70.08 87.03 0.56 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.954 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.75 -161.84 0.77 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.538 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -83.71 140.59 32.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.835 0.35 . . . . 0.0 110.827 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.47 -33.64 14.81 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.109 0.48 . . . . 0.0 111.075 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.6 t -100.33 27.0 6.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.943 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -57.37 113.75 1.9 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.987 0.422 . . . . 0.0 110.671 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.62 23.83 7.37 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.403 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -138.73 8.37 2.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.603 -0.272 . . . . 0.0 111.706 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -131.53 167.11 19.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.587 0.232 . . . . 0.0 110.809 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 18.0 mmtt -81.13 161.1 63.99 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 120.778 0.323 . . . . 0.0 110.96 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -57.86 124.26 15.58 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.624 2.216 . . . . 0.0 112.436 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -57.68 164.14 2.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.228 -179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.457 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -125.37 98.58 5.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.636 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.505 ' CE2' ' CG2' ' A' ' 30' ' ' THR . 7.0 p-90 36.87 -159.7 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.068 -0.514 . . . . 0.0 112.035 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.505 ' CG2' ' CE2' ' A' ' 29' ' ' TRP . 2.5 p 61.82 174.79 0.12 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.687 0.28 . . . . 0.0 110.406 -179.007 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 5.9 p90 -141.56 152.49 44.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.949 0.404 . . . . 0.0 111.122 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.3 t -89.85 -56.09 3.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.777 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -176.23 -46.38 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.563 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -109.4 151.53 26.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.639 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -67.58 -10.17 49.52 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 120.861 0.362 . . . . 0.0 111.789 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -91.17 -21.45 21.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.072 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -89.56 146.72 24.39 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.778 0.323 . . . . 0.0 111.069 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 8.0 ptpt -125.42 149.44 48.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.997 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 41.8 t -91.78 76.07 5.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.8 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 12.7 t -43.9 157.65 0.05 Allowed 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.388 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -95.46 102.09 13.86 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.822 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.227 -0.892 . . . . 0.0 112.297 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 14.6 tt . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.973 0.416 . . . . 0.0 111.053 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -101.52 -53.67 2.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.888 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 33.9 p90 -48.36 162.77 0.08 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.255 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -130.52 116.9 18.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.898 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 178.21 -42.34 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.921 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.41 ' O ' ' HB2' ' A' ' 7' ' ' GLN . 35.4 mtp -88.26 -175.94 5.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.903 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.416 ' N ' ' CE2' ' A' ' 31' ' ' TYR . 15.9 tt0 177.36 155.93 0.31 Allowed 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.788 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.46 161.34 9.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.179 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 3.8 p -120.16 10.27 11.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.213 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 16.9 m0 -54.59 -47.49 73.27 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.894 0.378 . . . . 0.0 111.103 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.68 31.12 6.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.837 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -138.29 38.9 2.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.906 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 52.0 m 61.95 115.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.936 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 156.97 149.17 5.32 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.531 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.8 t -126.58 94.86 2.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.893 0.378 . . . . 0.0 111.186 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 51.0 t -58.32 105.69 0.31 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.019 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.96 -166.54 1.18 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.809 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -89.07 133.48 34.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.887 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.34 -30.35 68.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.002 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 46.5 t -91.75 16.96 9.67 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.345 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -100.55 -42.51 6.53 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.732 0.301 . . . . 0.0 110.95 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 40.49 41.09 1.0 Allowed 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.869 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -110.94 13.57 22.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.13 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.4 t -132.43 178.64 6.67 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.788 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.16 168.44 11.28 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.781 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -69.4 119.31 6.29 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.531 2.154 . . . . 0.0 112.505 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.408 ' HG2' ' N ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -50.21 142.53 9.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.173 179.895 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.469 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -117.54 102.72 9.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.691 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.469 ' CD1' ' O ' ' A' ' 28' ' ' ALA . 5.9 p-90 36.79 -158.15 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.965 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.464 ' CG2' ' CE2' ' A' ' 29' ' ' TRP . 3.0 p 64.76 176.86 0.19 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.74 0.305 . . . . 0.0 110.59 -179.213 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.416 ' CE2' ' N ' ' A' ' 7' ' ' GLN . 6.7 p90 -140.39 153.13 46.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.07 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 38.0 t -97.84 -72.01 0.66 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.726 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -176.83 -48.82 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.751 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -103.19 138.13 40.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.752 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.4 mmp_? -68.52 -6.99 28.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.792 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -98.18 12.92 33.01 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.186 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 63.2 mm-40 -126.87 162.12 26.67 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.866 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -133.22 129.2 37.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.961 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.7 t -76.91 89.89 3.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.038 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.4 t -46.2 156.0 0.18 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.12 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -123.66 56.32 1.22 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.931 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 2.3 p90 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.22 -0.895 . . . . 0.0 112.095 -179.505 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 3.7 mp . . . . . 0 N--CA 1.485 1.287 0 CA-C-O 120.868 0.366 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 58.7 23.8 11.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.077 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 1.8 t80 177.23 150.68 0.18 Allowed 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.851 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -121.49 -77.27 0.58 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.83 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.412 ' O ' ' CG ' ' A' ' 5' ' ' GLU . 14.3 tt0 47.83 28.31 1.32 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.289 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.1 mtp -153.16 177.35 10.92 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.015 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 166.8 170.58 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.726 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.454 ' CB ' ' CD1' ' A' ' 10' ' ' TRP . . . -59.69 151.35 25.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.061 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 27.6 p -96.96 23.95 6.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.259 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.454 ' CD1' ' CB ' ' A' ' 8' ' ' ALA . 15.8 m95 -55.89 -36.22 67.41 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.865 0.364 . . . . 0.0 110.971 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 t -89.99 -44.33 9.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.793 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.62 -27.77 69.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.89 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.1 p 63.8 137.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.017 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -169.47 -159.24 14.73 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.271 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.416 ' O ' ' HB2' ' A' ' 40' ' ' CYS . 25.1 t -128.23 83.87 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.951 0.405 . . . . 0.0 111.212 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.4 t -58.8 95.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.934 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.02 -161.89 0.99 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.812 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.74 137.64 33.65 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.889 0.375 . . . . 0.0 110.832 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -50.71 -27.33 6.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.057 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.1 t -99.56 27.06 5.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.1 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.41 ' HB3' ' HB2' ' A' ' 24' ' ' CYS . 21.7 tp10 -60.4 118.5 6.54 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 121.012 0.434 . . . . 0.0 110.383 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.61 13.1 14.87 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.79 -179.154 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -150.26 43.96 0.87 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.904 0.383 . . . . 0.0 110.519 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.41 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 0.1 OUTLIER -116.63 -178.58 3.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.587 -178.983 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.72 166.7 15.68 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.602 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.02 109.23 2.84 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.58 2.187 . . . . 0.0 112.714 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.446 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -75.3 171.81 13.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.329 179.825 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.487 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -127.47 110.02 12.34 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.496 179.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.487 ' CD1' ' O ' ' A' ' 28' ' ' ALA . 2.2 p-90 41.91 -167.43 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.869 -179.587 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.439 HG21 ' CZ3' ' A' ' 29' ' ' TRP . 0.2 OUTLIER 56.61 167.44 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.749 -179.231 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 46.7 p90 -140.24 179.17 6.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.926 0.394 . . . . 0.0 111.201 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 30.9 t -89.94 -71.45 0.61 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.691 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -179.47 -56.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.68 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 31.4 t-20 -90.27 141.82 28.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.658 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.3 mmp_? -68.16 -7.3 28.86 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.277 -0.419 . . . . 0.0 112.022 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -89.71 -22.74 22.07 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.801 179.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -124.7 139.15 54.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.685 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.67 143.7 45.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.054 -179.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 8.2 t -75.9 105.0 6.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.611 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.446 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.3 OUTLIER -72.76 177.74 4.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.23 -179.817 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.94 118.8 22.02 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.913 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 27.5 p90 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.239 -0.886 . . . . 0.0 112.129 -179.559 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 2.5 pp . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.783 0.325 . . . . 0.0 111.099 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.1 tpt 60.93 94.41 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.926 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 60.64 97.63 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.865 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -164.54 133.56 3.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.852 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -43.51 -31.44 0.72 Allowed 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.613 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 6.8 mtt -77.76 -179.61 6.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.945 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 167.92 158.26 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.732 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.413 ' HB1' ' CD1' ' A' ' 10' ' ' TRP . . . -62.56 166.65 5.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.103 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 31.8 p -103.55 18.27 22.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.244 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.413 ' CD1' ' HB1' ' A' ' 8' ' ' ALA . 8.7 m95 -57.41 -31.99 66.41 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.865 0.364 . . . . 0.0 111.135 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 t -89.86 -42.2 11.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.872 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -68.43 -25.33 64.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.945 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.6 t 64.47 118.21 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.926 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -153.23 -157.57 8.12 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.456 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 31.1 t -128.15 94.07 2.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.809 0.338 . . . . 0.0 111.072 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.1 t -72.86 96.7 2.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.723 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.61 -162.21 0.86 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.666 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -77.72 137.1 38.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.762 0.315 . . . . 0.0 110.811 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -48.43 -28.4 3.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.143 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.5 t -96.89 29.89 2.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.802 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -57.9 118.76 5.69 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.735 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -83.28 7.48 16.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.786 -179.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -146.54 40.69 1.11 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.962 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.25 154.22 19.43 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.554 -178.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.8 mttt -107.85 158.79 32.57 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.774 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -67.78 90.86 0.36 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.546 2.164 . . . . 0.0 112.631 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.441 ' HB2' ' HA ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -70.3 168.8 15.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.286 179.757 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.483 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -118.15 106.12 12.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.138 179.451 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.483 ' CD1' ' O ' ' A' ' 28' ' ' ALA . 10.0 p-90 38.4 -160.11 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.907 -179.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.481 ' CG2' ' CE2' ' A' ' 29' ' ' TRP . 2.7 p 64.89 169.12 0.19 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.737 0.303 . . . . 0.0 110.555 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 38.1 p90 -141.81 174.66 10.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.026 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 35.4 t -89.9 -78.03 0.38 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.833 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 179.92 -54.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.707 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -89.9 139.66 30.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.786 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -67.96 -8.09 34.18 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.806 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 44.0 t-20 -89.98 -22.83 21.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.925 179.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 13.4 mp0 -127.69 147.23 50.38 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.775 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.14 149.06 50.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.177 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.5 t -80.06 127.4 32.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.681 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.441 ' HA ' ' HB2' ' A' ' 27' ' ' MET . 0.1 OUTLIER -112.27 169.55 8.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.192 -179.727 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -57.67 129.24 40.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.053 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 21.0 p90 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.208 -0.901 . . . . 0.0 112.073 -179.583 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 7.8 mt . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.863 0.363 . . . . 0.0 111.105 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.17 119.0 36.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.815 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 173.01 -34.77 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.918 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.419 ' O ' ' CD2' ' A' ' 4' ' ' PHE . 15.9 p90 -97.25 94.46 7.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.002 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -43.56 -69.58 0.13 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.478 -179.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 12.9 mtt -113.42 -178.15 3.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.898 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 168.88 -172.99 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.9 179.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.416 ' HB3' ' CD1' ' A' ' 10' ' ' TRP . . . -95.52 162.74 13.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.157 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.2 p -105.74 25.0 11.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.163 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.416 ' CD1' ' HB3' ' A' ' 8' ' ' ALA . 11.1 m95 -55.77 -39.2 70.89 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.879 0.371 . . . . 0.0 111.08 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.5 t -119.12 35.13 4.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.889 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -133.91 28.58 3.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.975 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.1 m 57.79 -175.48 0.07 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.997 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.01 163.45 24.86 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.462 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.1 t -118.2 96.91 4.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.907 0.385 . . . . 0.0 111.109 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 39.9 t -69.78 91.31 0.63 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.886 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.49 -167.04 1.33 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.507 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -111.13 74.75 0.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.868 0.366 . . . . 0.0 110.486 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.8 35.27 11.28 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.182 0.515 . . . . 0.0 109.97 -179.351 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.4 t -88.7 25.49 1.73 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.995 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -67.19 -1.95 5.1 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.625 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.97 10.45 11.78 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-O 120.787 0.327 . . . . 0.0 111.637 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.13 -23.96 0.25 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.309 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.01 -178.02 4.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.807 0.337 . . . . 0.0 111.032 -179.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.1 mmmt -87.28 164.07 37.16 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.848 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -60.35 119.67 6.99 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.657 2.238 . . . . 0.0 112.454 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 6.8 ptt? -55.59 169.47 0.32 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.022 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -103.87 179.0 4.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.73 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.429 ' CZ2' ' CG2' ' A' ' 30' ' ' THR . 45.9 p-90 -49.24 -44.67 43.77 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.315 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.429 ' CG2' ' CZ2' ' A' ' 29' ' ' TRP . 74.5 p -58.88 156.43 11.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 9.7 p90 -133.14 -179.23 5.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.926 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.04 -71.73 0.67 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.995 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -178.49 -48.89 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.765 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -89.9 139.55 30.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.918 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -66.13 -11.23 47.81 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.73 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -91.98 -24.03 19.36 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.043 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -97.72 135.69 39.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.833 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.64 143.37 47.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.041 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.3 t -91.31 89.02 7.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.967 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 2.8 t -50.44 153.86 1.45 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.04 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -102.68 95.2 6.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.828 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 6.2 p90 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.221 -0.895 . . . . 0.0 112.226 -179.564 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 8.5 pt . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.966 0.412 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.0 tmm? 61.73 80.76 0.21 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.938 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 60.6 111.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.853 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 12.8 p90 -110.04 135.88 50.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.884 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -43.73 -31.5 0.82 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.557 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 37.8 mmm -69.33 177.98 2.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.008 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 169.33 -169.98 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.747 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.41 156.14 37.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.107 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.5 p -95.55 22.73 6.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.106 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 15.5 m0 -59.39 -25.46 64.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.302 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.4 t -89.96 -33.53 16.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.995 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -83.76 -25.12 30.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.051 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.4 m 65.82 122.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.945 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -154.22 -161.37 10.41 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.339 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.406 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 29.2 t -116.14 87.09 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.884 0.373 . . . . 0.0 111.103 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.6 t -57.22 91.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.108 -179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.6 ttt85 -107.27 -158.64 0.66 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.565 179.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -93.02 146.79 23.37 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.825 0.345 . . . . 0.0 110.977 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.37 -26.81 8.41 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.03 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.439 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 33.3 t -97.95 32.72 2.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.459 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -61.45 117.07 5.22 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.178 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.439 ' HG3' ' O ' ' A' ' 20' ' ' SER . 0.0 OUTLIER -119.41 16.61 13.01 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.346 179.757 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -125.64 -26.51 3.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.662 0.268 . . . . 0.0 111.568 -179.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.71 -176.43 4.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.954 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.49 161.79 38.55 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.94 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -64.42 115.22 3.06 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.502 2.135 . . . . 0.0 112.18 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.79 156.22 11.57 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.067 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.473 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -127.89 105.26 8.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.511 179.64 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.473 ' CD1' ' O ' ' A' ' 28' ' ' ALA . 1.1 p-90 48.32 -179.74 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.344 -179.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.431 ' OG1' ' CE2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER 59.74 167.72 0.07 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.615 -179.308 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 5.6 p90 -144.09 178.31 7.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.146 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 38.6 t -89.89 -65.82 0.98 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.814 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -174.12 -55.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.713 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -91.44 149.87 21.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.694 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -68.6 -9.61 50.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.752 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -91.67 -18.89 23.3 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.223 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -106.26 150.99 25.38 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.853 0.359 . . . . 0.0 111.012 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -131.77 137.3 48.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.901 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.3 t -76.63 92.19 3.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.07 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.406 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 0.0 OUTLIER -58.72 156.55 10.84 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.571 179.831 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -58.06 124.04 17.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.029 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 15.3 p90 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.228 -0.891 . . . . 0.0 112.106 -179.638 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.419 HD12 ' CZ ' ' A' ' 3' ' ' PHE . 16.9 pt . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.828 0.347 . . . . 0.0 111.165 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.3 mtt -89.85 -25.17 21.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.037 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.419 ' CZ ' HD12 ' A' ' 1' ' ' ILE . 1.9 m-85 63.63 149.44 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.917 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -98.6 31.43 2.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.96 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -43.55 -32.03 0.85 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.552 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 49.7 mtp -129.22 -178.39 4.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.015 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 175.24 -167.61 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.661 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -112.23 176.23 5.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.215 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.5 p -114.43 28.81 8.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.075 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 8.3 m0 -52.67 -28.49 21.88 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.076 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 40.6 t -138.0 34.54 2.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.839 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -120.82 15.61 11.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.263 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 62.52 124.59 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.856 0.36 . . . . 0.0 111.058 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 162.11 164.83 17.9 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.474 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.422 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 1.5 t -112.96 106.04 19.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.854 0.359 . . . . 0.0 111.243 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 46.2 t -81.45 101.08 9.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.944 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.2 ttt85 -144.44 -161.59 1.31 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.756 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -70.65 139.87 51.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.907 0.384 . . . . 0.0 110.87 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.446 ' HA ' ' HG2' ' A' ' 38' ' ' LYS . 25.4 mtpt -79.33 -55.23 5.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.895 -179.368 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.7 t -82.3 7.97 12.5 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.936 -179.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -107.67 -72.74 0.71 Allowed 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 120.722 0.296 . . . . 0.0 111.541 -179.575 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.22 156.75 33.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.046 0.451 . . . . 0.0 111.8 -179.341 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -115.82 56.49 0.77 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.155 179.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.72 -175.11 4.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.016 -179.461 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.56 167.75 5.15 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.595 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -76.24 105.74 2.13 Favored 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.415 2.077 . . . . 0.0 112.554 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 14.5 ptt? -45.75 167.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.056 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -117.1 -177.54 3.23 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.024 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 56.0 p-90 -43.2 -39.24 2.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.354 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 32.4 p -60.18 146.74 42.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.589 179.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -137.71 177.96 7.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.926 0.393 . . . . 0.0 111.233 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.19 -70.47 0.7 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.794 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -170.74 -39.16 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.626 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -108.38 144.52 35.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.528 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -69.13 -7.75 39.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.303 -0.408 . . . . 0.0 112.002 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -89.84 2.84 54.47 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.38 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -127.23 141.4 51.74 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.742 0.306 . . . . 0.0 110.894 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.446 ' HG2' ' HA ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -116.13 155.36 28.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.079 -179.843 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 11.9 t -104.28 85.0 2.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.389 179.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.422 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 5.0 t -42.81 136.27 2.68 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.215 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -86.65 112.73 21.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.897 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.174 -0.917 . . . . 0.0 112.358 -179.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 1.9 pt . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.835 0.35 . . . . 0.0 111.133 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 41.6 ttp -79.7 -66.49 0.87 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.933 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -48.15 127.76 12.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.29 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -81.81 108.97 15.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.931 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -43.15 -74.54 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.601 -179.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 7.6 mtt -139.1 -173.71 3.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.894 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 173.38 169.83 0.16 Allowed 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.831 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.426 ' HB3' ' CD1' ' A' ' 10' ' ' TRP . . . -72.92 164.53 26.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.141 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 26.5 p -109.5 22.21 16.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.131 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.426 ' CD1' ' HB3' ' A' ' 8' ' ' ALA . 6.3 m95 -57.31 -51.23 70.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.963 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 21.7 t -89.93 7.89 35.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.333 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -111.54 -22.48 11.23 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.754 0.312 . . . . 0.0 111.161 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 66.65 146.37 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.952 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -179.91 -149.62 8.64 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.421 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.7 t -142.73 87.66 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.804 0.335 . . . . 0.0 111.0 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 48.0 t -66.42 94.35 0.27 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.652 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.04 -171.5 2.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.674 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.431 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 2.2 m-20 -72.81 135.45 45.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.848 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.08 -37.27 76.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.953 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.1 t -101.95 33.12 3.15 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.893 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.431 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 0.9 OUTLIER -75.06 -174.51 2.29 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.095 179.768 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -123.38 17.4 9.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.507 -179.478 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.08 37.34 0.7 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.833 0.349 . . . . 0.0 110.819 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -95.47 133.18 39.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.087 -179.655 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.402 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 9.5 mmtp -93.32 158.64 36.74 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.854 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' A' ' 25' ' ' LYS . 5.9 Cg_endo -48.04 90.89 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.681 2.254 . . . . 0.0 112.337 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.0 ppp? -54.67 165.4 0.6 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.432 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.465 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -134.81 93.45 3.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.652 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.47 ' CE2' ' CG2' ' A' ' 30' ' ' THR . 9.5 p-90 37.29 -158.96 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.889 -179.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.47 ' CG2' ' CE2' ' A' ' 29' ' ' TRP . 1.7 p 62.78 -177.02 0.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.793 0.33 . . . . 0.0 110.607 -179.104 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -152.65 160.62 43.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.916 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 41.0 t -89.99 -71.74 0.6 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.815 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -165.42 -68.98 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.899 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -90.04 153.61 20.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.82 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -68.41 -8.57 41.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.991 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -89.87 -20.92 22.84 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.053 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -122.81 128.55 50.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.809 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -117.24 150.96 37.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.146 -179.82 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.2 t -80.85 83.33 6.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.552 179.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -66.55 176.83 1.75 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.089 -179.696 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -63.72 118.87 8.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.015 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 2.8 p90 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.229 -0.891 . . . . 0.0 112.062 -179.585 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 2.7 pt . . . . . 0 N--CA 1.485 1.304 0 CA-C-O 120.687 0.28 . . . . 0.0 111.07 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 37.72 -93.45 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.822 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -53.91 106.72 0.2 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.759 0.314 . . . . 0.0 111.143 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -176.9 153.77 1.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.928 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 177.97 61.44 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.703 179.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.6 mtp -141.27 -162.59 1.4 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.756 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 177.72 175.8 0.45 Allowed 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.938 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.437 ' CB ' ' CE3' ' A' ' 10' ' ' TRP . . . -81.77 172.58 13.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.267 -179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.5 p -111.19 23.4 14.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.996 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.437 ' CE3' ' CB ' ' A' ' 8' ' ' ALA . 5.9 m0 -58.3 -19.9 38.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.411 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.8 t -89.71 -51.58 5.44 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.821 0.343 . . . . 0.0 111.227 -179.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -88.82 8.69 27.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.566 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 52.5 -168.04 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.819 0.342 . . . . 0.0 111.077 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 152.11 -166.4 31.0 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.531 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.4 t -119.7 92.63 2.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.814 0.34 . . . . 0.0 111.033 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 51.2 t -74.27 101.88 4.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.965 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.64 -163.89 1.44 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.763 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -78.0 136.92 38.04 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.865 0.364 . . . . 0.0 110.955 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.7 mttt -58.48 -27.08 64.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.978 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.6 t -107.09 35.6 2.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.738 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -74.61 168.79 19.09 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 121.132 0.491 . . . . 0.0 110.407 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.08 16.14 16.04 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.492 -179.547 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -150.2 31.51 0.68 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.882 0.372 . . . . 0.0 110.648 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.7 146.65 23.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.115 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.421 ' CB ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -95.96 167.21 12.91 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.81 179.962 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.421 ' HD2' ' CB ' ' A' ' 25' ' ' LYS . 9.5 Cg_endo -50.8 87.82 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.66 2.24 . . . . 0.0 112.417 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.405 ' N ' ' O ' ' A' ' 25' ' ' LYS . 5.4 ppp? -60.48 166.43 3.13 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.207 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -123.3 177.08 5.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.948 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.424 ' CZ2' HG21 ' A' ' 30' ' ' THR . 63.4 p-90 -48.08 -28.85 3.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.248 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.424 HG21 ' CZ2' ' A' ' 29' ' ' TRP . 26.6 p -67.88 148.94 50.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.857 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 41.5 p90 -136.21 -177.53 4.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.907 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.81 -70.87 0.64 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.908 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 179.16 -44.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.766 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -90.06 144.04 26.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.863 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -67.21 -10.92 55.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.839 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -89.97 -21.97 22.16 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.139 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 71.2 mm-40 -123.72 143.14 50.46 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.942 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -130.31 160.79 32.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.001 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.8 t -93.37 106.07 18.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.711 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 m -86.2 175.08 8.69 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.958 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -63.56 115.87 5.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.947 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 38.3 p90 . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.214 -0.898 . . . . 0.0 112.144 -179.529 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.431 HG23 ' CZ ' ' A' ' 3' ' ' PHE . 1.2 tt . . . . . 0 N--CA 1.485 1.306 0 CA-C-O 121.004 0.431 . . . . 0.0 111.039 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 64.63 15.26 9.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.402 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.431 ' CZ ' HG23 ' A' ' 1' ' ' ILE . 20.3 p90 172.49 157.97 0.1 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.799 0.333 . . . . 0.0 110.825 179.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.402 ' O ' ' HB2' ' A' ' 5' ' ' GLU . 27.5 m-85 -127.18 -175.39 3.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.878 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.402 ' HB2' ' O ' ' A' ' 4' ' ' PHE . 0.4 OUTLIER 179.47 -38.89 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.864 179.647 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.3 mtt -59.35 -162.76 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.745 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 175.11 151.64 0.11 Allowed 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 120.828 0.346 . . . . 0.0 110.904 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.93 165.95 8.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.194 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 11.8 p -102.32 28.02 6.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.889 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 18.7 m0 -56.03 -28.78 58.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.203 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.2 t -89.97 -64.4 1.14 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.018 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 64.9 t-80 -57.07 -28.67 62.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.038 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.8 p 62.78 121.54 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.012 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -135.48 -133.27 3.23 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.467 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.5 t -144.22 85.52 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.758 0.314 . . . . 0.0 111.236 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.1 t -70.07 96.56 1.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.736 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.54 -162.92 1.18 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.745 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.37 132.79 38.73 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.95 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -50.8 -29.54 11.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.972 0.415 . . . . 0.0 110.876 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.0 t -104.22 32.39 4.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.979 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -67.68 140.42 56.8 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.338 0.59 . . . . 0.0 110.295 179.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.85 14.61 15.02 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.621 -179.294 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -150.35 34.47 0.64 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.822 0.344 . . . . 0.0 110.8 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -94.1 162.62 13.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.321 -179.498 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.411 ' CD ' ' HD2' ' A' ' 26' ' ' PRO . 22.5 mmtm -115.94 164.25 18.36 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.621 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.411 ' HD2' ' CD ' ' A' ' 25' ' ' LYS . 9.1 Cg_endo -50.69 90.25 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.571 2.181 . . . . 0.0 112.572 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -57.0 164.98 1.38 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.19 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -117.69 178.03 4.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.058 179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.42 ' CE2' HG22 ' A' ' 30' ' ' THR . 38.5 p-90 -48.07 -29.75 3.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.344 -179.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.42 HG22 ' CE2' ' A' ' 29' ' ' TRP . 29.1 p -58.3 150.41 22.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.034 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -127.18 176.69 7.19 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.916 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 25.7 t -103.31 -67.07 0.9 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.895 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.1 tp10 -178.77 -63.99 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.733 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 20.4 t30 -89.96 149.82 22.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.796 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.1 mmp_? -67.69 -8.45 35.21 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.079 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 36.4 t-20 -89.66 -23.11 21.97 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.805 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -120.04 130.5 54.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.487 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.91 145.57 47.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.307 -179.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.9 t -83.31 97.26 8.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.644 179.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -71.55 170.44 13.36 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.934 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.409 ' O ' ' C ' ' A' ' 42' ' ' TYR . 2.6 tt0 -93.72 116.9 29.41 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.188 -179.647 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.409 ' C ' ' O ' ' A' ' 41' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.261 -0.876 . . . . 0.0 112.449 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.411 HD13 HG21 ' A' ' 1' ' ' ILE . 26.4 mm . . . . . 0 N--CA 1.485 1.3 0 CA-C-O 120.785 0.326 . . . . 0.0 111.123 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.8 mtt -114.4 101.47 9.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.883 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 172.41 -40.89 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.798 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 4.0 t80 60.22 110.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.829 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 178.11 -39.04 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.933 179.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 7.0 mtt -106.18 178.83 4.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.981 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 168.01 -171.34 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.79 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.415 ' HB2' ' CE1' ' A' ' 31' ' ' TYR . . . -85.17 174.24 9.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.986 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 12.1 m -97.19 21.71 9.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.12 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 9.1 m0 -56.85 -32.77 66.12 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.821 0.344 . . . . 0.0 111.016 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.3 t -97.69 -43.78 7.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.981 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.421 ' CD2' ' CG2' ' A' ' 30' ' ' THR . 37.2 m-70 -58.1 -31.6 67.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.947 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t 62.33 31.34 17.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.086 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.96 -164.27 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.217 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.467 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 1.1 t -116.74 94.44 3.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.938 0.399 . . . . 0.0 110.994 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.3 t -67.34 106.7 2.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.984 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.7 -158.65 0.65 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.657 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.27 142.41 27.44 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.838 0.351 . . . . 0.0 110.803 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.06 -37.54 69.42 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.889 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.6 t -74.94 -11.47 60.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.131 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -98.81 92.48 5.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.807 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.42 ' N ' ' CD ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -97.06 40.63 1.14 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.893 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.12 -26.84 20.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.968 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.98 177.87 6.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.789 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.53 144.12 92.76 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.747 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -88.18 95.41 0.4 Allowed 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.937 2.424 . . . . 0.0 112.8 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.424 ' HG2' ' NE1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -76.22 100.92 5.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.644 179.628 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -102.46 55.64 0.78 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.011 0.434 . . . . 0.0 111.657 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.436 ' CH2' HG22 ' A' ' 30' ' ' THR . 5.1 p-90 -168.1 -43.6 0.02 OUTLIER 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.481 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.436 HG22 ' CH2' ' A' ' 29' ' ' TRP . 7.7 p -101.33 168.87 9.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.703 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.415 ' CE1' ' HB2' ' A' ' 8' ' ' ALA . 23.2 p90 -140.09 166.06 25.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.191 -179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 35.7 t -89.92 -75.08 0.46 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.937 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -176.0 -46.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.786 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 33.0 t-20 -101.91 145.64 28.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.749 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -69.49 -8.67 48.97 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.868 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 -89.99 -17.22 28.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.145 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 9.2 mp0 -106.59 166.34 10.63 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.905 0.383 . . . . 0.0 110.872 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.02 113.97 8.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.732 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 9.1 t -59.34 136.89 58.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.943 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.467 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 13.3 t -97.97 136.23 38.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.677 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.82 89.69 4.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.938 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 30.0 p90 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.238 -0.887 . . . . 0.0 112.114 -179.603 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 4.1 tt . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 120.919 0.39 . . . . 0.0 111.02 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 37.8 mtt -105.84 109.04 20.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.914 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -47.97 105.92 0.08 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.156 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -72.41 167.66 20.07 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.075 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 178.45 39.46 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.576 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 2.8 mmm -105.01 -152.26 0.46 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.722 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -175.71 146.19 0.74 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 120.819 0.343 . . . . 0.0 110.825 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.417 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . . . -55.09 177.26 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.244 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.02 8.89 27.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.215 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.417 ' CD1' ' HB2' ' A' ' 8' ' ' ALA . 8.0 m95 -54.57 -29.84 52.49 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.816 0.341 . . . . 0.0 111.091 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.6 t -108.65 40.07 1.87 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.918 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -164.26 -51.25 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.863 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 61.64 100.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.897 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -119.6 -117.09 2.62 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.478 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.7 t -132.45 80.42 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.855 0.36 . . . . 0.0 111.15 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.3 t -72.49 89.54 1.27 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.639 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -140.49 -166.58 2.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.768 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.43 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 11.8 t70 -66.17 136.11 55.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.864 0.364 . . . . 0.0 110.695 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.8 mtmm -60.69 -29.54 69.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.736 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.6 t -107.66 35.77 2.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.605 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.43 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 0.5 OUTLIER -75.46 -164.5 0.34 Allowed 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.4 -179.982 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -118.99 18.16 13.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.695 0.283 . . . . 0.0 111.201 -179.758 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -148.18 35.7 0.82 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.876 0.37 . . . . 0.0 110.69 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -97.29 126.94 42.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.999 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.3 mtpp -113.08 163.56 17.76 Favored Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.964 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.74 91.67 0.09 OUTLIER 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.55 2.167 . . . . 0.0 112.58 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' MET . . . . . 0.453 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -77.97 171.72 14.57 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.175 0.512 . . . . 0.0 111.286 179.812 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.482 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -122.76 108.9 13.56 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.437 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.482 ' CD1' ' O ' ' A' ' 28' ' ' ALA . 9.3 p-90 37.49 -159.32 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.098 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.471 ' CG2' ' CE2' ' A' ' 29' ' ' TRP . 3.0 p 65.4 157.37 0.1 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.737 0.303 . . . . 0.0 110.592 -179.216 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 31.4 p90 -136.72 175.38 9.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.092 -179.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.7 t -98.38 -73.58 0.61 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.987 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -179.59 -51.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.868 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -90.0 136.7 32.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.881 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -69.74 -6.73 33.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.807 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -89.96 -19.21 24.76 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.879 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -131.22 141.53 50.05 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.892 0.377 . . . . 0.0 110.801 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.36 158.59 23.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.835 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 9.8 t -89.99 80.76 6.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.815 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.453 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.0 OUTLIER -65.3 171.23 3.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.779 179.955 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -63.86 120.72 12.45 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.061 -179.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 2.9 p90 . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.235 -0.888 . . . . 0.0 112.045 -179.721 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 35.6 mtm . . . . . 0 CA--C 1.527 0.077 0 CA-C-O 120.806 0.336 . . . . 0.0 110.787 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 172.57 172.45 0.11 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.793 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.36 176.44 0.25 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.133 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.2 p -111.11 29.68 7.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.969 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 9.3 m0 -54.55 -31.97 57.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.18 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.0 t -97.45 -57.92 2.13 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.987 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.537 ' CB ' HG21 ' A' ' 30' ' ' THR . 21.3 t-80 -57.85 -26.8 62.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.054 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.97 163.46 0.1 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.935 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 164.88 174.46 34.63 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.556 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.431 HG23 ' HA ' ' A' ' 42' ' ' TYR . 21.5 t -91.94 105.66 16.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.854 0.359 . . . . 0.0 111.122 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.9 t -79.02 96.09 5.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.84 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.2 -164.3 1.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.888 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 77.1 m-20 -74.46 138.55 43.32 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.86 0.362 . . . . 0.0 111.214 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.405 ' HA ' ' HG2' ' A' ' 38' ' ' LYS . 0.7 OUTLIER -52.52 -29.25 24.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.2 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.0 t -103.87 33.45 3.42 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.002 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 8.6 tt0 -65.44 133.99 52.48 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 121.287 0.565 . . . . 0.0 110.641 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.65 14.73 7.89 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.404 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.18 38.5 0.72 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.001 0.429 . . . . 0.0 110.39 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.98 154.51 19.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.17 -179.48 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.441 ' CB ' ' CD ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -105.54 179.08 0.98 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.876 -179.896 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.441 ' CD ' ' CB ' ' A' ' 25' ' ' LYS . 33.1 Cg_exo -59.91 80.22 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.514 2.143 . . . . 0.0 112.402 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.404 ' CB ' ' HA ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -55.84 164.03 1.27 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.05 179.932 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -124.78 177.55 5.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.059 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 65.7 p-90 -47.55 -29.91 3.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.397 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.537 HG21 ' CB ' ' A' ' 12' ' ' HIS . 20.0 p -65.48 151.99 45.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.907 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 28.4 p90 -137.06 -179.14 5.53 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.887 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.5 t -89.92 -66.29 0.94 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.828 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 178.53 -56.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.66 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -89.98 150.16 22.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.742 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -69.15 -8.03 41.73 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.933 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -89.76 -19.79 24.32 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.003 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 58.6 mm-40 -125.76 131.6 52.48 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.774 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.405 ' HG2' ' HA ' ' A' ' 19' ' ' LYS . 5.2 ptpt -117.3 153.56 32.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.154 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.9 t -96.33 94.63 7.56 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.609 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.404 ' HA ' ' CB ' ' A' ' 27' ' ' MET . 0.8 OUTLIER -76.9 177.19 7.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.082 -179.816 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.81 115.94 11.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.886 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.431 ' HA ' HG23 ' A' ' 15' ' ' VAL . 15.6 p90 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.227 -0.892 . . . . 0.0 112.118 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 3.5 mmt . . . . . 0 N--CA 1.457 -0.088 0 CA-C-O 120.819 0.342 . . . . 0.0 110.869 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 175.99 170.72 0.39 Allowed 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.833 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.4 ' HB3' ' CD1' ' A' ' 10' ' ' TRP . . . -68.45 -172.93 0.38 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.049 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.2 p -117.1 24.85 10.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.993 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.4 ' CD1' ' HB3' ' A' ' 8' ' ' ALA . 7.8 m95 -57.36 -27.3 62.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.142 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.7 t -89.94 -32.88 16.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.969 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -80.03 -29.62 39.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.845 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.6 m 62.12 84.31 0.14 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.913 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -113.82 -145.39 9.1 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.837 -0.696 . . . . 0.0 112.477 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.494 HG23 ' HA ' ' A' ' 42' ' ' TYR . 21.4 t -131.13 102.65 6.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.822 0.344 . . . . 0.0 111.082 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.9 t -79.81 103.27 9.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.952 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.12 -165.48 1.37 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.66 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.479 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 9.0 t70 -71.27 136.53 47.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.962 0.411 . . . . 0.0 110.972 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.423 ' HA ' ' HG2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -49.97 -36.35 27.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.027 0.441 . . . . 0.0 111.049 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.6 t -101.43 31.85 3.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.966 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.479 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 7.6 tp10 -61.94 129.95 43.33 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.214 0.531 . . . . 0.0 110.447 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.6 16.2 4.07 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.632 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -150.18 40.19 0.78 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.99 0.424 . . . . 0.0 110.374 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.85 147.79 23.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.215 -179.358 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.466 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 0.1 OUTLIER -98.2 172.08 5.2 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.638 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.466 ' HD2' ' HB3' ' A' ' 25' ' ' LYS . 45.3 Cg_exo -57.11 83.38 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.447 2.098 . . . . 0.0 112.541 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.553 ' HE2' ' HD3' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -54.67 168.19 0.3 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.253 179.917 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -120.26 173.17 7.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.867 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.634 ' CH2' HG22 ' A' ' 30' ' ' THR . 46.6 p-90 -47.07 -29.02 1.93 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.408 -179.741 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.634 HG22 ' CH2' ' A' ' 29' ' ' TRP . 44.3 p -65.33 165.1 12.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.087 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -135.39 -179.41 5.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.842 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 49.0 t -93.39 -78.65 0.42 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.007 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -179.49 -51.44 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.01 -179.935 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -89.87 144.27 26.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.888 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -66.75 -12.06 57.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.686 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -90.07 -22.63 21.72 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.126 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -128.06 138.55 52.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.79 0.329 . . . . 0.0 111.059 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.553 ' HD3' ' HE2' ' A' ' 27' ' ' MET . 0.0 OUTLIER -123.28 158.36 31.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.043 -179.903 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 33.9 t -90.52 113.67 25.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.957 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -98.51 179.45 4.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.788 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.408 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -63.9 127.26 30.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.786 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.494 ' HA ' HG23 ' A' ' 15' ' ' VAL . 29.0 p90 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.232 -0.889 . . . . 0.0 112.17 -179.555 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 8.8 mmm . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.793 0.33 . . . . 0.0 110.894 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 168.42 155.03 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.795 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.81 166.67 2.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.021 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 29.3 p -105.09 20.06 19.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.25 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -57.52 -27.99 63.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.762 0.315 . . . . 0.0 111.092 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.9 t -90.09 -64.6 1.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.951 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.5 -23.93 59.22 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.154 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 66.21 147.85 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.931 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -171.35 -164.68 27.43 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.526 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.5 t -115.96 95.97 4.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.814 0.34 . . . . 0.0 111.148 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.4 t -72.02 95.84 1.65 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.778 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.4 -168.04 1.99 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.774 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -74.9 136.78 41.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.8 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.7 mttm -53.83 -28.06 33.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.918 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 29.3 t -105.31 34.53 3.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.739 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -73.22 149.29 42.95 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.297 0.57 . . . . 0.0 110.616 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -98.65 17.57 18.89 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.127 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -148.01 28.93 0.91 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.833 0.349 . . . . 0.0 110.682 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.35 147.47 23.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.995 -179.627 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.443 ' HB3' ' HB3' ' A' ' 41' ' ' GLU . 1.1 mptp? -101.07 177.54 1.49 Allowed Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.747 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.411 ' CD ' ' CB ' ' A' ' 25' ' ' LYS . 47.5 Cg_exo -56.67 82.86 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.434 2.089 . . . . 0.0 112.525 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.406 ' N ' ' O ' ' A' ' 25' ' ' LYS . 5.5 ppp? -52.82 164.42 0.38 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.299 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -124.49 174.53 7.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.051 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.471 ' CH2' HG22 ' A' ' 30' ' ' THR . 55.2 p-90 -49.16 -30.66 7.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.287 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.471 HG22 ' CH2' ' A' ' 29' ' ' TRP . 13.2 p -58.66 158.24 8.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.899 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -129.46 172.38 11.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.859 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 40.8 t -90.03 -73.78 0.51 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.937 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -179.13 -49.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.736 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -89.97 140.91 29.17 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.787 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -70.53 -6.98 40.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.946 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -89.91 -14.03 35.05 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.17 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.41 161.59 35.03 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.801 0.334 . . . . 0.0 110.787 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -130.54 162.53 29.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.113 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.6 t -99.91 104.77 16.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.86 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 m -81.31 176.87 9.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.737 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.443 ' HB3' ' HB3' ' A' ' 25' ' ' LYS . 0.3 OUTLIER -71.05 116.62 11.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.717 179.908 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 1.8 p90 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.245 -0.884 . . . . 0.0 112.198 -179.512 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 72.3 mtp . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.81 0.338 . . . . 0.0 111.16 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.451 ' N ' ' CE2' ' A' ' 31' ' ' TYR . 0.0 OUTLIER 174.58 157.62 0.16 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.723 179.728 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.79 156.81 10.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.235 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.6 p -115.1 25.8 10.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.966 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 11.8 m0 -55.45 -38.44 69.05 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.131 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -108.26 30.35 6.49 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.046 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.8 m80 -147.36 21.21 1.2 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.146 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 53.25 178.84 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.781 0.324 . . . . 0.0 111.025 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 145.42 171.79 15.32 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.615 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.4 t -120.19 85.12 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.837 0.351 . . . . 0.0 111.074 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.7 t -61.69 94.78 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.976 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.58 -163.63 0.92 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.624 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -88.59 137.73 32.06 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.738 0.304 . . . . 0.0 110.897 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.1 mtpp -50.86 -30.77 15.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.913 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.9 t -99.23 25.12 7.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.851 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -60.51 118.26 6.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.087 0.47 . . . . 0.0 110.565 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.29 12.31 18.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.558 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -150.08 40.13 0.78 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.169 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -98.84 179.17 4.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.609 -179.181 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.7 mmtt -115.18 164.69 16.13 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.289 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -50.52 90.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.483 2.122 . . . . 0.0 112.651 -179.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.42 ' CB ' ' HA ' ' A' ' 40' ' ' CYS . 0.1 OUTLIER -60.15 168.54 1.91 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.98 179.727 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -122.26 174.3 7.07 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.931 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.763 ' CH2' HG22 ' A' ' 30' ' ' THR . 37.5 p-90 -49.38 -26.76 3.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.451 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.763 HG22 ' CH2' ' A' ' 29' ' ' TRP . 15.7 p -66.94 157.92 32.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.85 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.451 ' CE2' ' N ' ' A' ' 7' ' ' GLN . 15.1 p90 -137.37 177.51 7.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.967 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 4.1 t -89.92 -67.37 0.85 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.986 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -179.45 -53.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.701 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 55.3 t30 -90.0 152.44 21.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.751 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -66.79 -11.55 55.52 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.824 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -90.01 -22.64 21.78 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.082 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -114.87 134.35 55.21 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.753 0.311 . . . . 0.0 110.992 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.415 ' NZ ' ' HG2' ' A' ' 27' ' ' MET . 0.0 OUTLIER -122.63 154.82 37.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.121 179.976 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 9.0 t -87.5 99.28 11.91 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.589 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.42 ' HA ' ' CB ' ' A' ' 27' ' ' MET . 0.7 OUTLIER -79.83 174.84 11.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.302 -179.548 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -58.13 106.77 0.4 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.005 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 10.5 p90 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.235 -0.888 . . . . 0.0 112.053 -179.584 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 30.6 mmm . . . . . 0 CA--C 1.527 0.065 0 CA-C-O 120.768 0.318 . . . . 0.0 110.752 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 169.94 179.82 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.817 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.515 ' HB3' ' NE1' ' A' ' 10' ' ' TRP . . . -100.51 -177.21 3.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.133 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 27.3 p -109.89 27.77 9.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.0 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.515 ' NE1' ' HB3' ' A' ' 8' ' ' ALA . 9.7 m95 -54.49 -31.25 55.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.033 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.4 t -97.3 -52.2 3.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.849 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -59.62 -25.95 65.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.945 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.5 p 63.32 143.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.974 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -165.87 -134.48 1.68 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.5 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.436 ' CG2' ' HA ' ' A' ' 42' ' ' TYR . 21.8 t -141.06 82.02 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.859 0.362 . . . . 0.0 111.068 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.0 t -66.37 89.32 0.14 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.808 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.18 -166.26 1.2 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.738 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.66 136.23 41.92 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.825 0.345 . . . . 0.0 110.91 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.4 mttt -63.53 -34.95 78.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.653 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.1 t -104.79 34.76 3.02 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.41 179.66 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.85 -175.63 3.55 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.351 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -123.04 17.96 10.04 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.496 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.02 40.0 0.78 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.88 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -97.14 146.97 24.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.039 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.491 ' CB ' ' HD2' ' A' ' 26' ' ' PRO . 1.0 OUTLIER -106.15 170.83 5.37 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.763 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.491 ' HD2' ' CB ' ' A' ' 25' ' ' LYS . 9.5 Cg_endo -52.49 87.72 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.393 2.062 . . . . 0.0 112.246 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.402 ' N ' ' O ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -62.46 165.77 5.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.137 -179.902 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -115.13 177.69 4.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.012 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 64.1 p-90 -49.97 -36.18 27.19 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.292 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 19.1 p -58.92 148.78 29.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.967 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 16.8 p90 -130.68 179.96 5.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.917 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.5 t -94.43 -69.5 0.75 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.892 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.4 pp20? 178.54 -46.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.862 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -96.66 146.87 24.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.862 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -69.14 -8.3 44.24 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.871 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -89.8 -19.28 24.88 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.059 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -129.39 141.12 51.14 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.812 0.339 . . . . 0.0 110.853 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -131.78 158.06 42.22 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.095 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 17.8 t -86.26 93.15 8.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.591 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -82.07 166.41 19.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.975 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.88 139.23 52.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.935 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.436 ' HA ' ' CG2' ' A' ' 15' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.237 -0.887 . . . . 0.0 112.277 -179.587 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 8.3 mtt . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.747 0.308 . . . . 0.0 110.88 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 178.05 -172.45 0.12 Allowed 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.924 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.59 157.29 35.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.254 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.5 p -107.89 25.45 11.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.97 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 18.1 m0 -55.99 -32.1 63.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.256 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.0 t -89.98 -34.3 16.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.962 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -70.0 -16.42 63.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.276 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 67.34 126.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.859 0.361 . . . . 0.0 110.929 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -172.87 -167.8 33.3 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.825 -0.703 . . . . 0.0 112.288 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.424 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 24.4 t -122.84 95.16 3.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.967 0.413 . . . . 0.0 111.166 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.7 t -62.51 86.25 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.894 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.38 -163.21 1.02 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.765 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -96.07 142.01 28.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.842 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.16 -40.69 90.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.894 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.7 t -73.42 -11.89 60.62 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.136 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -102.62 95.14 6.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.829 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.43 ' CD ' ' N ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -97.67 40.29 1.17 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.967 -179.794 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -98.35 24.76 6.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.96 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -121.69 -173.73 2.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.683 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.26 155.4 84.14 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.645 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -64.16 103.33 0.42 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.418 2.079 . . . . 0.0 112.328 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 12.6 ptm -60.81 163.62 5.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.129 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.437 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -134.41 104.76 6.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.824 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.437 ' CD1' ' O ' ' A' ' 28' ' ' ALA . 0.5 OUTLIER 47.75 -178.71 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.418 -179.815 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 63.37 161.72 0.1 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.633 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -139.32 -178.86 5.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.945 0.402 . . . . 0.0 111.229 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 36.1 t -89.84 -64.03 1.2 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.762 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -178.47 -44.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.679 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 60.5 t30 -107.89 150.49 26.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.663 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -69.85 -7.0 36.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.926 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -89.74 -17.83 27.51 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.965 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -119.13 149.34 41.87 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.817 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -121.52 162.43 20.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.952 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 15.4 t -95.82 83.21 3.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.825 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.424 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -55.7 154.04 7.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.668 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.65 107.99 5.43 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.059 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 28.4 p90 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.079 -179.6 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 40.2 mtt . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.72 0.295 . . . . 0.0 110.869 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 175.53 160.41 0.25 Allowed 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.918 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.37 153.66 40.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.184 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.5 p -113.81 19.6 16.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.18 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 50.3 m0 -56.51 -44.74 81.04 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.831 0.348 . . . . 0.0 111.082 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.85 -20.21 23.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.239 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 13.0 m-70 -96.18 24.28 5.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.069 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.0 t 56.95 179.95 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.989 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 139.24 166.0 10.45 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.476 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.486 HG23 ' HA ' ' A' ' 42' ' ' TYR . 21.2 t -116.1 87.86 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.868 0.366 . . . . 0.0 111.17 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 49.5 t -67.05 99.69 0.68 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.939 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.51 -164.65 1.12 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.603 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -83.1 138.3 33.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.824 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.1 mttm -49.76 -29.81 8.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.949 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.8 t -103.4 28.17 6.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.711 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 -60.63 117.52 5.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.715 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.76 12.92 13.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.446 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -149.29 42.67 0.93 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.204 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -104.21 173.18 6.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.479 -179.112 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -104.34 168.13 8.98 Favored Pre-proline 0 C--N 1.332 -0.189 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.546 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.78 93.57 0.32 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.48 2.12 . . . . 0.0 112.545 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.482 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 3.5 ptm -59.24 168.77 1.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.38 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.49 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -147.95 109.42 4.37 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.02 179.357 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.983 ' CE2' HG23 ' A' ' 30' ' ' THR . 2.8 p-90 38.58 -159.1 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.277 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.983 HG23 ' CE2' ' A' ' 29' ' ' TRP . 2.1 p 51.73 -179.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.864 0.364 . . . . 0.0 111.294 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.2 p90 -154.69 179.59 8.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.733 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 41.1 t -90.29 -72.72 0.55 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.797 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -178.61 -39.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.711 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -107.5 147.91 29.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.775 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.3 mmp_? -67.98 -8.79 40.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.983 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -89.82 -22.2 22.21 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.003 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -123.45 144.04 49.76 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.803 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -122.09 157.11 32.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.185 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 16.9 t -85.53 117.41 24.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.547 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.482 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.6 OUTLIER -96.57 176.6 5.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.328 -179.544 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.93 105.2 2.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.965 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.486 ' HA ' HG23 ' A' ' 15' ' ' VAL . 1.7 p90 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.224 -0.893 . . . . 0.0 112.084 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' MET . . . . . 0.441 ' HB3' ' CD2' ' A' ' 31' ' ' TYR . 6.0 mmt . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.878 0.37 . . . . 0.0 110.974 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.759 ' O ' HG22 ' A' ' 30' ' ' THR . 6.3 tp60 177.76 159.63 0.47 Allowed 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.771 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.6 147.33 32.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.048 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 15.1 p -95.08 18.61 11.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.216 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 20.4 m0 -57.33 -42.93 82.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.818 0.342 . . . . 0.0 111.013 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.38 -20.36 22.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.278 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -95.39 23.26 6.07 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.267 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.6 m 57.78 -168.46 0.12 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.033 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.402 ' N ' ' HB3' ' A' ' 42' ' ' TYR . . . 116.72 156.84 10.74 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.304 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.476 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 34.4 t -112.64 85.93 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.965 0.412 . . . . 0.0 111.07 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 46.4 t -57.56 100.64 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.178 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -119.27 -159.72 0.78 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.468 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -84.88 144.27 28.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.912 0.386 . . . . 0.0 110.967 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.6 mmtm -49.09 -27.35 3.31 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.244 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.41 ' O ' ' CD ' ' A' ' 22' ' ' ARG . 12.4 t -94.1 29.77 2.06 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.743 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.58 114.28 2.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.987 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.41 ' CD ' ' O ' ' A' ' 20' ' ' SER . 0.0 OUTLIER -115.64 19.15 15.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.194 179.839 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -123.38 -32.12 3.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.705 0.288 . . . . 0.0 111.392 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.7 -171.3 3.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.828 0.347 . . . . 0.0 110.893 -179.623 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.3 mtpt -98.33 167.69 11.12 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.93 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -66.9 123.16 10.64 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.535 2.156 . . . . 0.0 112.311 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.5 153.66 15.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.002 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -130.94 102.23 5.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.919 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.412 ' CD1' ' OG1' ' A' ' 30' ' ' THR . 0.0 OUTLIER 54.28 173.29 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.814 -179.858 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.759 HG22 ' O ' ' A' ' 7' ' ' GLN . 0.2 OUTLIER 67.02 162.9 0.18 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.549 -179.459 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.441 ' CD2' ' HB3' ' A' ' 6' ' ' MET . 8.0 p90 -135.56 169.63 17.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.965 0.412 . . . . 0.0 110.948 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 41.1 t -89.92 -64.14 1.18 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.782 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -178.38 -49.16 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.643 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -106.75 148.61 28.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.684 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -69.25 -7.34 35.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.927 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -89.95 -19.31 24.65 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.112 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 9.5 mp0 -109.8 148.24 31.83 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.833 0.349 . . . . 0.0 111.03 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.5 132.4 53.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.857 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.6 t -77.87 97.3 5.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.992 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.476 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -57.47 154.26 11.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.761 179.85 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -57.96 110.0 0.84 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.995 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.402 ' HB3' ' N ' ' A' ' 14' ' ' GLY . 13.9 p90 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.231 -0.89 . . . . 0.0 112.045 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 3.9 mtp . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.926 0.393 . . . . 0.0 110.994 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 65.61 -176.16 0.18 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.837 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.44 ' HB3' ' CD1' ' A' ' 10' ' ' TRP . . . -96.71 -179.55 4.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.202 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.5 p -114.47 26.24 10.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.942 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.44 ' CD1' ' HB3' ' A' ' 8' ' ' ALA . 14.8 m95 -55.91 -47.63 77.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.078 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 47.4 t -98.23 30.96 2.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.94 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -145.49 29.43 1.14 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.806 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.8 m 58.35 -176.12 0.08 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.933 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 110.97 156.5 14.36 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.485 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.491 HG22 ' CE1' ' A' ' 42' ' ' TYR . 15.9 t -122.07 114.84 44.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.868 0.366 . . . . 0.0 111.135 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 37.5 t -70.08 87.03 0.56 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.954 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.75 -161.84 0.77 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.538 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -83.71 140.59 32.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.835 0.35 . . . . 0.0 110.827 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.47 -33.64 14.81 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.109 0.48 . . . . 0.0 111.075 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.6 t -100.33 27.0 6.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.943 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.417 ' CG ' ' HB2' ' A' ' 24' ' ' CYS . 4.2 tp10 -57.37 113.75 1.9 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.987 0.422 . . . . 0.0 110.671 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.62 23.83 7.37 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.403 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -138.73 8.37 2.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.603 -0.272 . . . . 0.0 111.706 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.417 ' HB2' ' CG ' ' A' ' 21' ' ' GLU . 0.5 OUTLIER -131.53 167.11 19.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.587 0.232 . . . . 0.0 110.809 -179.695 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 18.0 mmtt -81.13 161.1 63.99 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 120.778 0.323 . . . . 0.0 110.96 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -57.86 124.26 15.58 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.624 2.216 . . . . 0.0 112.436 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -57.68 164.14 2.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.228 -179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.457 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -125.37 98.58 5.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.636 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.505 ' CE2' ' CG2' ' A' ' 30' ' ' THR . 7.0 p-90 36.87 -159.7 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.068 -0.514 . . . . 0.0 112.035 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.505 ' CG2' ' CE2' ' A' ' 29' ' ' TRP . 2.5 p 61.82 174.79 0.12 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.687 0.28 . . . . 0.0 110.406 -179.007 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 5.9 p90 -141.56 152.49 44.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.949 0.404 . . . . 0.0 111.122 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.3 t -89.85 -56.09 3.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.777 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -176.23 -46.38 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.563 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -109.4 151.53 26.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.639 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -67.58 -10.17 49.52 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 120.861 0.362 . . . . 0.0 111.789 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -91.17 -21.45 21.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.072 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -89.56 146.72 24.39 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.778 0.323 . . . . 0.0 111.069 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 8.0 ptpt -125.42 149.44 48.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.997 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 41.8 t -91.78 76.07 5.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.8 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 12.7 t -43.9 157.65 0.05 Allowed 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.388 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -95.46 102.09 13.86 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.822 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.491 ' CE1' HG22 ' A' ' 15' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.227 -0.892 . . . . 0.0 112.297 -179.634 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' MET . . . . . 0.417 ' O ' ' HB2' ' A' ' 7' ' ' GLN . 35.4 mtp . . . . . 0 C--O 1.23 0.065 0 CA-C-O 120.754 0.312 . . . . 0.0 110.903 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 6' ' ' MET . 15.9 tt0 177.36 155.93 0.31 Allowed 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.788 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.46 161.34 9.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.179 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 3.8 p -120.16 10.27 11.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.213 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 16.9 m0 -54.59 -47.49 73.27 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.894 0.378 . . . . 0.0 111.103 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.68 31.12 6.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.837 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -138.29 38.9 2.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.906 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 52.0 m 61.95 115.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.936 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 156.97 149.17 5.32 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.531 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.8 t -126.58 94.86 2.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.893 0.378 . . . . 0.0 111.186 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 51.0 t -58.32 105.69 0.31 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.019 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.96 -166.54 1.18 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.809 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -89.07 133.48 34.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.887 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.34 -30.35 68.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.002 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 46.5 t -91.75 16.96 9.67 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.345 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -100.55 -42.51 6.53 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.732 0.301 . . . . 0.0 110.95 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 40.49 41.09 1.0 Allowed 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.869 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -110.94 13.57 22.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.13 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.4 t -132.43 178.64 6.67 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.788 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.403 ' CB ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -67.16 168.44 11.28 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.781 179.935 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.403 ' HD2' ' CB ' ' A' ' 25' ' ' LYS . 51.0 Cg_endo -69.4 119.31 6.29 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.531 2.154 . . . . 0.0 112.505 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.405 ' HG2' ' N ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -50.21 142.53 9.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.173 179.895 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.469 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -117.54 102.72 9.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.691 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.553 ' CE2' HG22 ' A' ' 30' ' ' THR . 5.9 p-90 36.79 -158.15 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.965 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.553 HG22 ' CE2' ' A' ' 29' ' ' TRP . 3.0 p 64.76 176.86 0.19 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.74 0.305 . . . . 0.0 110.59 -179.213 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.416 ' CE2' ' N ' ' A' ' 7' ' ' GLN . 6.7 p90 -140.39 153.13 46.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.07 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 38.0 t -97.84 -72.01 0.66 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.726 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -176.83 -48.82 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.751 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -103.19 138.13 40.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.752 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.4 mmp_? -68.52 -6.99 28.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.792 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -98.18 12.92 33.01 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.186 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 63.2 mm-40 -126.87 162.12 26.67 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.866 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -133.22 129.2 37.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.961 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.7 t -76.91 89.89 3.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.038 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.4 t -46.2 156.0 0.18 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.12 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -123.66 56.32 1.22 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.931 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 2.3 p90 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.22 -0.895 . . . . 0.0 112.095 -179.505 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.1 mtp . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.743 0.306 . . . . 0.0 111.015 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.477 ' O ' HG22 ' A' ' 30' ' ' THR . 4.8 mt-30 166.8 170.58 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.726 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.454 ' CB ' ' CD1' ' A' ' 10' ' ' TRP . . . -59.69 151.35 25.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.061 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 27.6 p -96.96 23.95 6.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.259 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.454 ' CD1' ' CB ' ' A' ' 8' ' ' ALA . 15.8 m95 -55.89 -36.22 67.41 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.865 0.364 . . . . 0.0 110.971 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 t -89.99 -44.33 9.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.793 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.62 -27.77 69.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.89 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.1 p 63.8 137.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.017 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -169.47 -159.24 14.73 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.271 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.428 ' O ' ' HB2' ' A' ' 40' ' ' CYS . 25.1 t -128.23 83.87 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.951 0.405 . . . . 0.0 111.212 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.4 t -58.8 95.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.934 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.02 -161.89 0.99 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.812 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.403 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 0.2 OUTLIER -83.74 137.64 33.65 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.889 0.375 . . . . 0.0 110.832 179.992 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -50.71 -27.33 6.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.057 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.1 t -99.56 27.06 5.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.1 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.423 ' HB3' ' HB2' ' A' ' 24' ' ' CYS . 21.7 tp10 -60.4 118.5 6.54 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 121.012 0.434 . . . . 0.0 110.383 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.61 13.1 14.87 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.79 -179.154 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -150.26 43.96 0.87 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.904 0.383 . . . . 0.0 110.519 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.423 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 0.1 OUTLIER -116.63 -178.58 3.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.587 -178.983 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.72 166.7 15.68 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.602 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.02 109.23 2.84 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.58 2.187 . . . . 0.0 112.714 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.468 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -75.3 171.81 13.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.329 179.825 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.487 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -127.47 110.02 12.34 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.496 179.68 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.689 ' CZ2' HG23 ' A' ' 30' ' ' THR . 2.2 p-90 41.91 -167.43 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.869 -179.587 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.689 HG23 ' CZ2' ' A' ' 29' ' ' TRP . 0.2 OUTLIER 56.61 167.44 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.749 -179.231 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 46.7 p90 -140.24 179.17 6.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.926 0.394 . . . . 0.0 111.201 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 30.9 t -89.94 -71.45 0.61 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.691 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -179.47 -56.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.68 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 31.4 t-20 -90.27 141.82 28.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.658 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.3 mmp_? -68.16 -7.3 28.86 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.277 -0.419 . . . . 0.0 112.022 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -89.71 -22.74 22.07 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.801 179.693 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -124.7 139.15 54.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.685 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.67 143.7 45.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.054 -179.759 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 8.2 t -75.9 105.0 6.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.611 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.468 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.3 OUTLIER -72.76 177.74 4.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.23 -179.817 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.94 118.8 22.02 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.913 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 27.5 p90 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.239 -0.886 . . . . 0.0 112.129 -179.559 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 6.8 mtt . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.746 0.308 . . . . 0.0 110.945 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 167.92 158.26 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.732 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.56 166.65 5.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.103 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 31.8 p -103.55 18.27 22.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.244 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 8.7 m95 -57.41 -31.99 66.41 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.865 0.364 . . . . 0.0 111.135 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 t -89.86 -42.2 11.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.872 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -68.43 -25.33 64.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.945 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.6 t 64.47 118.21 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.926 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -153.23 -157.57 8.12 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.456 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 31.1 t -128.15 94.07 2.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.809 0.338 . . . . 0.0 111.072 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.1 t -72.86 96.7 2.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.723 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.61 -162.21 0.86 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.666 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -77.72 137.1 38.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.762 0.315 . . . . 0.0 110.811 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -48.43 -28.4 3.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.143 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.5 t -96.89 29.89 2.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.802 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.407 ' HG3' ' N ' ' A' ' 24' ' ' CYS . 6.3 tp10 -57.9 118.76 5.69 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.735 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -83.28 7.48 16.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.786 -179.585 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -146.54 40.69 1.11 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.962 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.407 ' N ' ' HG3' ' A' ' 21' ' ' GLU . 0.1 OUTLIER -91.25 154.22 19.43 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.554 -178.955 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.8 mttt -107.85 158.79 32.57 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.774 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -67.78 90.86 0.36 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.546 2.164 . . . . 0.0 112.631 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.452 ' HB2' ' HA ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -70.3 168.8 15.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.286 179.757 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.483 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -118.15 106.12 12.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.138 179.451 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.503 ' CE2' HG22 ' A' ' 30' ' ' THR . 10.0 p-90 38.4 -160.11 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.907 -179.495 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.503 HG22 ' CE2' ' A' ' 29' ' ' TRP . 2.7 p 64.89 169.12 0.19 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.737 0.303 . . . . 0.0 110.555 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 38.1 p90 -141.81 174.66 10.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.026 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 35.4 t -89.9 -78.03 0.38 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.833 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 179.92 -54.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.707 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -89.9 139.66 30.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.786 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -67.96 -8.09 34.18 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.806 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 44.0 t-20 -89.98 -22.83 21.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.925 179.803 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -127.69 147.23 50.38 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.775 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.14 149.06 50.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.177 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.5 t -80.06 127.4 32.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.681 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.452 ' HA ' ' HB2' ' A' ' 27' ' ' MET . 0.1 OUTLIER -112.27 169.55 8.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.192 -179.727 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -57.67 129.24 40.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.053 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 21.0 p90 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.208 -0.901 . . . . 0.0 112.073 -179.583 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 12.9 mtt . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.764 0.316 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 168.88 -172.99 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.9 179.725 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.407 ' CB ' ' NE1' ' A' ' 10' ' ' TRP . . . -95.52 162.74 13.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.157 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.2 p -105.74 25.0 11.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.163 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.407 ' NE1' ' CB ' ' A' ' 8' ' ' ALA . 11.1 m95 -55.77 -39.2 70.89 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.879 0.371 . . . . 0.0 111.08 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.5 t -119.12 35.13 4.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.889 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -133.91 28.58 3.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.975 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.1 m 57.79 -175.48 0.07 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.997 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.01 163.45 24.86 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.462 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.413 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 3.1 t -118.2 96.91 4.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.907 0.385 . . . . 0.0 111.109 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 39.9 t -69.78 91.31 0.63 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.886 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.49 -167.04 1.33 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.507 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -111.13 74.75 0.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.868 0.366 . . . . 0.0 110.486 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.8 35.27 11.28 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.182 0.515 . . . . 0.0 109.97 -179.351 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.4 t -88.7 25.49 1.73 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.995 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -67.19 -1.95 5.1 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.625 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.97 10.45 11.78 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-O 120.787 0.327 . . . . 0.0 111.637 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.13 -23.96 0.25 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.309 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.01 -178.02 4.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.807 0.337 . . . . 0.0 111.032 -179.727 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.1 mmmt -87.28 164.07 37.16 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.848 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -60.35 119.67 6.99 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.657 2.238 . . . . 0.0 112.454 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 6.8 ptt? -55.59 169.47 0.32 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.022 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -103.87 179.0 4.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.73 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.74 ' CE2' HG23 ' A' ' 30' ' ' THR . 45.9 p-90 -49.24 -44.67 43.77 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.315 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.74 HG23 ' CE2' ' A' ' 29' ' ' TRP . 74.5 p -58.88 156.43 11.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 9.7 p90 -133.14 -179.23 5.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.926 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.04 -71.73 0.67 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.995 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -178.49 -48.89 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.765 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -89.9 139.55 30.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.918 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -66.13 -11.23 47.81 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.73 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -91.98 -24.03 19.36 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.043 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -97.72 135.69 39.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.833 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.64 143.37 47.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.041 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.3 t -91.31 89.02 7.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.967 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.413 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 2.8 t -50.44 153.86 1.45 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.04 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -102.68 95.2 6.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.828 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 6.2 p90 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.221 -0.895 . . . . 0.0 112.226 -179.564 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 37.8 mmm . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.809 0.338 . . . . 0.0 111.008 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.428 ' O ' HG22 ' A' ' 30' ' ' THR . 1.4 mt-30 169.33 -169.98 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.747 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.41 156.14 37.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.107 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.5 p -95.55 22.73 6.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.106 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 15.5 m0 -59.39 -25.46 64.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.302 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.4 t -89.96 -33.53 16.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.995 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -83.76 -25.12 30.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.051 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.4 m 65.82 122.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.945 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -154.22 -161.37 10.41 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.339 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.41 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 29.2 t -116.14 87.09 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.884 0.373 . . . . 0.0 111.103 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.6 t -57.22 91.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.108 -179.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.6 ttt85 -107.27 -158.64 0.66 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.565 179.706 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -93.02 146.79 23.37 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.825 0.345 . . . . 0.0 110.977 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.37 -26.81 8.41 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.03 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.442 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 33.3 t -97.95 32.72 2.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.459 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -61.45 117.07 5.22 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.178 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.442 ' HG3' ' O ' ' A' ' 20' ' ' SER . 0.0 OUTLIER -119.41 16.61 13.01 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.346 179.757 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -125.64 -26.51 3.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.662 0.268 . . . . 0.0 111.568 -179.549 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.71 -176.43 4.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.954 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.49 161.79 38.55 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.94 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -64.42 115.22 3.06 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.502 2.135 . . . . 0.0 112.18 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.79 156.22 11.57 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.067 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.473 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -127.89 105.26 8.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.511 179.64 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.514 ' CH2' HG23 ' A' ' 30' ' ' THR . 1.1 p-90 48.32 -179.74 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.344 -179.53 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.514 HG23 ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER 59.74 167.72 0.07 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.615 -179.308 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 5.6 p90 -144.09 178.31 7.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.146 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 38.6 t -89.89 -65.82 0.98 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.814 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -174.12 -55.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.713 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -91.44 149.87 21.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.694 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -68.6 -9.61 50.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.752 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -91.67 -18.89 23.3 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.223 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -106.26 150.99 25.38 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.853 0.359 . . . . 0.0 111.012 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -131.77 137.3 48.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.901 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.3 t -76.63 92.19 3.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.07 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.41 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 0.0 OUTLIER -58.72 156.55 10.84 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.571 179.831 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -58.06 124.04 17.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.029 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 15.3 p90 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.228 -0.891 . . . . 0.0 112.106 -179.638 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 49.7 mtp . . . . . 0 N--CA 1.457 -0.109 0 CA-C-O 120.854 0.359 . . . . 0.0 111.015 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 175.24 -167.61 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.661 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -112.23 176.23 5.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.215 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.5 p -114.43 28.81 8.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.075 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 8.3 m0 -52.67 -28.49 21.88 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.076 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 40.6 t -138.0 34.54 2.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.839 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -120.82 15.61 11.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.263 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 62.52 124.59 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.856 0.36 . . . . 0.0 111.058 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 162.11 164.83 17.9 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.474 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.456 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 1.5 t -112.96 106.04 19.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.854 0.359 . . . . 0.0 111.243 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 46.2 t -81.45 101.08 9.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.944 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.2 ttt85 -144.44 -161.59 1.31 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.756 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.419 ' CB ' ' HB3' ' A' ' 21' ' ' GLU . 1.5 m-20 -70.65 139.87 51.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.907 0.384 . . . . 0.0 110.87 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.472 ' CE ' ' HE2' ' A' ' 27' ' ' MET . 25.4 mtpt -79.33 -55.23 5.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.895 -179.368 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.7 t -82.3 7.97 12.5 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.936 -179.252 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.419 ' HB3' ' CB ' ' A' ' 18' ' ' ASP . 0.8 OUTLIER -107.67 -72.74 0.71 Allowed 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 120.722 0.296 . . . . 0.0 111.541 -179.575 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.22 156.75 33.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.046 0.451 . . . . 0.0 111.8 -179.341 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -115.82 56.49 0.77 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.155 179.475 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.72 -175.11 4.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.016 -179.461 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.56 167.75 5.15 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.595 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -76.24 105.74 2.13 Favored 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.415 2.077 . . . . 0.0 112.554 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.472 ' HE2' ' CE ' ' A' ' 19' ' ' LYS . 14.5 ptt? -45.75 167.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.056 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -117.1 -177.54 3.23 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.024 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 56.0 p-90 -43.2 -39.24 2.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.354 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 32.4 p -60.18 146.74 42.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.589 179.797 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -137.71 177.96 7.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.926 0.393 . . . . 0.0 111.233 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.19 -70.47 0.7 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.794 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -170.74 -39.16 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.626 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -108.38 144.52 35.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.528 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -69.13 -7.75 39.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.303 -0.408 . . . . 0.0 112.002 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -89.84 2.84 54.47 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.38 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -127.23 141.4 51.74 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.742 0.306 . . . . 0.0 110.894 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.454 ' HG2' ' HA ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -116.13 155.36 28.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.079 -179.843 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 11.9 t -104.28 85.0 2.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.389 179.519 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.456 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 5.0 t -42.81 136.27 2.68 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.215 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -86.65 112.73 21.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.897 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.174 -0.917 . . . . 0.0 112.358 -179.535 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 7.6 mtt . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.786 0.327 . . . . 0.0 110.894 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 173.38 169.83 0.16 Allowed 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.831 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.532 ' HB1' ' CE2' ' A' ' 10' ' ' TRP . . . -72.92 164.53 26.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.141 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 26.5 p -109.5 22.21 16.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.131 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.532 ' CE2' ' HB1' ' A' ' 8' ' ' ALA . 6.3 m95 -57.31 -51.23 70.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.963 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 21.7 t -89.93 7.89 35.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.333 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -111.54 -22.48 11.23 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.754 0.312 . . . . 0.0 111.161 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 66.65 146.37 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.952 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -179.91 -149.62 8.64 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.421 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.736 HG23 ' HA ' ' A' ' 42' ' ' TYR . 21.7 t -142.73 87.66 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.804 0.335 . . . . 0.0 111.0 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 48.0 t -66.42 94.35 0.27 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.652 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.04 -171.5 2.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.674 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.455 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 2.2 m-20 -72.81 135.45 45.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.848 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.402 ' HG2' ' HG2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -59.08 -37.27 76.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.953 179.994 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.1 t -101.95 33.12 3.15 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.893 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.455 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 0.9 OUTLIER -75.06 -174.51 2.29 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.095 179.768 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -123.38 17.4 9.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.507 -179.478 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.08 37.34 0.7 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.833 0.349 . . . . 0.0 110.819 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -95.47 133.18 39.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.087 -179.655 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.5 mmtp -93.32 158.64 36.74 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.854 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -48.04 90.89 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.681 2.254 . . . . 0.0 112.337 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.422 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 2.0 ppp? -54.67 165.4 0.6 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.432 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.465 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -134.81 93.45 3.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.652 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.526 ' CE2' HG22 ' A' ' 30' ' ' THR . 9.5 p-90 37.29 -158.96 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.889 -179.768 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.526 HG22 ' CE2' ' A' ' 29' ' ' TRP . 1.7 p 62.78 -177.02 0.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.793 0.33 . . . . 0.0 110.607 -179.104 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -152.65 160.62 43.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.916 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 41.0 t -89.99 -71.74 0.6 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.815 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -165.42 -68.98 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.899 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -90.04 153.61 20.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.82 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -68.41 -8.57 41.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.991 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -89.87 -20.92 22.84 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.053 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -122.81 128.55 50.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.809 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.402 ' HG2' ' HG2' ' A' ' 19' ' ' LYS . 0.1 OUTLIER -117.24 150.96 37.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.146 -179.82 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.2 t -80.85 83.33 6.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.552 179.67 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.422 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.2 OUTLIER -66.55 176.83 1.75 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.089 -179.696 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -63.72 118.87 8.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.015 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.736 ' HA ' HG23 ' A' ' 15' ' ' VAL . 2.8 p90 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.229 -0.891 . . . . 0.0 112.062 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.6 mtp . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.801 0.334 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 177.72 175.8 0.45 Allowed 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.938 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.56 ' HB3' ' CE3' ' A' ' 10' ' ' TRP . . . -81.77 172.58 13.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.267 -179.881 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.5 p -111.19 23.4 14.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.996 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.56 ' CE3' ' HB3' ' A' ' 8' ' ' ALA . 5.9 m0 -58.3 -19.9 38.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.411 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.8 t -89.71 -51.58 5.44 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.821 0.343 . . . . 0.0 111.227 -179.69 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -88.82 8.69 27.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.566 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 52.5 -168.04 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.819 0.342 . . . . 0.0 111.077 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 152.11 -166.4 31.0 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.531 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.413 HG23 ' HA ' ' A' ' 42' ' ' TYR . 21.4 t -119.7 92.63 2.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.814 0.34 . . . . 0.0 111.033 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 51.2 t -74.27 101.88 4.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.965 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.64 -163.89 1.44 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.763 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -78.0 136.92 38.04 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.865 0.364 . . . . 0.0 110.955 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.7 mttt -58.48 -27.08 64.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.978 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.6 t -107.09 35.6 2.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.738 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -74.61 168.79 19.09 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 121.132 0.491 . . . . 0.0 110.407 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.08 16.14 16.04 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.492 -179.547 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -150.2 31.51 0.68 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.882 0.372 . . . . 0.0 110.648 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.7 146.65 23.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.115 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.422 ' CB ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -95.96 167.21 12.91 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.81 179.962 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.422 ' HD2' ' CB ' ' A' ' 25' ' ' LYS . 9.5 Cg_endo -50.8 87.82 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.66 2.24 . . . . 0.0 112.417 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.405 ' N ' ' O ' ' A' ' 25' ' ' LYS . 5.4 ppp? -60.48 166.43 3.13 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.207 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -123.3 177.08 5.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.948 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 63.4 p-90 -48.08 -28.85 3.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.248 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 26.6 p -67.88 148.94 50.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.857 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 41.5 p90 -136.21 -177.53 4.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.907 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.81 -70.87 0.64 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.908 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 179.16 -44.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.766 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -90.06 144.04 26.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.863 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -67.21 -10.92 55.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.839 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -89.97 -21.97 22.16 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.139 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 71.2 mm-40 -123.72 143.14 50.46 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.942 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -130.31 160.79 32.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.001 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.8 t -93.37 106.07 18.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.711 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 m -86.2 175.08 8.69 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.958 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.416 ' HB3' ' HB3' ' A' ' 25' ' ' LYS . 2.0 tp10 -63.56 115.87 5.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.947 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.413 ' HA ' HG23 ' A' ' 15' ' ' VAL . 38.3 p90 . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.214 -0.898 . . . . 0.0 112.144 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.3 mtt . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.643 0.259 . . . . 0.0 110.745 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 175.11 151.64 0.11 Allowed 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 120.828 0.346 . . . . 0.0 110.904 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.93 165.95 8.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.194 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 11.8 p -102.32 28.02 6.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.889 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 18.7 m0 -56.03 -28.78 58.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.203 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.2 t -89.97 -64.4 1.14 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.018 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 64.9 t-80 -57.07 -28.67 62.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.038 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.8 p 62.78 121.54 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.012 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -135.48 -133.27 3.23 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.467 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.419 HG12 ' HD3' ' A' ' 17' ' ' ARG . 21.5 t -144.22 85.52 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.758 0.314 . . . . 0.0 111.236 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.1 t -70.07 96.56 1.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.736 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.419 ' HD3' HG12 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -126.54 -162.92 1.18 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.745 -179.953 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 1.1 m-20 -77.37 132.79 38.73 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.95 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -50.8 -29.54 11.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.972 0.415 . . . . 0.0 110.876 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.0 t -104.22 32.39 4.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.979 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 10.9 tp10 -67.68 140.42 56.8 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.338 0.59 . . . . 0.0 110.295 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.85 14.61 15.02 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.621 -179.294 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -150.35 34.47 0.64 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.822 0.344 . . . . 0.0 110.8 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -94.1 162.62 13.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.321 -179.498 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.44 ' CD ' ' HD2' ' A' ' 26' ' ' PRO . 22.5 mmtm -115.94 164.25 18.36 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.621 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.44 ' HD2' ' CD ' ' A' ' 25' ' ' LYS . 9.1 Cg_endo -50.69 90.25 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.571 2.181 . . . . 0.0 112.572 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.41 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 0.7 OUTLIER -57.0 164.98 1.38 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.19 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -117.69 178.03 4.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.058 179.798 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.5 ' CH2' HG22 ' A' ' 30' ' ' THR . 38.5 p-90 -48.07 -29.75 3.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.344 -179.867 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.5 HG22 ' CH2' ' A' ' 29' ' ' TRP . 29.1 p -58.3 150.41 22.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.034 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -127.18 176.69 7.19 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.916 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 25.7 t -103.31 -67.07 0.9 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.895 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.1 tp10 -178.77 -63.99 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.733 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -89.96 149.82 22.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.796 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.1 mmp_? -67.69 -8.45 35.21 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.079 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 36.4 t-20 -89.66 -23.11 21.97 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.805 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -120.04 130.5 54.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.487 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.91 145.57 47.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.307 -179.802 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.9 t -83.31 97.26 8.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.644 179.628 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.41 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.8 OUTLIER -71.55 170.44 13.36 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.934 -179.697 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.425 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 2.6 tt0 -93.72 116.9 29.41 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.188 -179.647 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.409 ' C ' ' O ' ' A' ' 41' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.261 -0.876 . . . . 0.0 112.449 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 7.0 mtt . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.76 0.314 . . . . 0.0 110.981 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 168.01 -171.34 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.79 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.43 ' HB2' ' CE1' ' A' ' 31' ' ' TYR . . . -85.17 174.24 9.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.986 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 12.1 m -97.19 21.71 9.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.12 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 9.1 m0 -56.85 -32.77 66.12 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.821 0.344 . . . . 0.0 111.016 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.3 t -97.69 -43.78 7.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.981 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.894 ' CD2' HG21 ' A' ' 30' ' ' THR . 37.2 m-70 -58.1 -31.6 67.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.947 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t 62.33 31.34 17.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.086 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.96 -164.27 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.217 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.493 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 1.1 t -116.74 94.44 3.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.938 0.399 . . . . 0.0 110.994 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.3 t -67.34 106.7 2.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.984 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.7 -158.65 0.65 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.657 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.27 142.41 27.44 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.838 0.351 . . . . 0.0 110.803 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.06 -37.54 69.42 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.889 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.6 t -74.94 -11.47 60.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.131 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -98.81 92.48 5.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.807 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.42 ' CD ' ' N ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -97.06 40.63 1.14 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.893 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.12 -26.84 20.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.968 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.98 177.87 6.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.789 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.53 144.12 92.76 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.747 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -88.18 95.41 0.4 Allowed 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.937 2.424 . . . . 0.0 112.8 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.451 ' HG2' ' NE1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -76.22 100.92 5.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.644 179.628 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -102.46 55.64 0.78 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.011 0.434 . . . . 0.0 111.657 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.851 ' CE3' HG23 ' A' ' 30' ' ' THR . 5.1 p-90 -168.1 -43.6 0.02 OUTLIER 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.481 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.894 HG21 ' CD2' ' A' ' 12' ' ' HIS . 7.7 p -101.33 168.87 9.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.703 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.43 ' CE1' ' HB2' ' A' ' 8' ' ' ALA . 23.2 p90 -140.09 166.06 25.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.191 -179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 35.7 t -89.92 -75.08 0.46 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.937 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -176.0 -46.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.786 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 33.0 t-20 -101.91 145.64 28.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.749 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -69.49 -8.67 48.97 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.868 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 -89.99 -17.22 28.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.145 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 9.2 mp0 -106.59 166.34 10.63 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.905 0.383 . . . . 0.0 110.872 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.02 113.97 8.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.732 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 9.1 t -59.34 136.89 58.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.943 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.493 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 13.3 t -97.97 136.23 38.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.677 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.82 89.69 4.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.938 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 30.0 p90 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.238 -0.887 . . . . 0.0 112.114 -179.603 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 2.8 mmm . . . . . 0 CA--C 1.531 0.225 0 CA-C-O 120.502 0.191 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -175.71 146.19 0.74 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 120.819 0.343 . . . . 0.0 110.825 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.728 ' HB3' ' CD1' ' A' ' 10' ' ' TRP . . . -55.09 177.26 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.244 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.02 8.89 27.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.215 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.728 ' CD1' ' HB3' ' A' ' 8' ' ' ALA . 8.0 m95 -54.57 -29.84 52.49 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.816 0.341 . . . . 0.0 111.091 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.6 t -108.65 40.07 1.87 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.918 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -164.26 -51.25 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.863 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 61.64 100.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.897 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -119.6 -117.09 2.62 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.478 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.593 HG23 ' HA ' ' A' ' 42' ' ' TYR . 21.7 t -132.45 80.42 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.855 0.36 . . . . 0.0 111.15 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.3 t -72.49 89.54 1.27 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.639 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -140.49 -166.58 2.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.768 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.456 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 11.8 t70 -66.17 136.11 55.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.864 0.364 . . . . 0.0 110.695 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.8 mtmm -60.69 -29.54 69.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.736 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.6 t -107.66 35.77 2.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.605 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.456 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 0.5 OUTLIER -75.46 -164.5 0.34 Allowed 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.4 -179.982 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -118.99 18.16 13.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.695 0.283 . . . . 0.0 111.201 -179.758 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -148.18 35.7 0.82 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.876 0.37 . . . . 0.0 110.69 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -97.29 126.94 42.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.999 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.3 mtpp -113.08 163.56 17.76 Favored Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.964 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.74 91.67 0.09 OUTLIER 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.55 2.167 . . . . 0.0 112.58 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' MET . . . . . 0.465 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -77.97 171.72 14.57 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.175 0.512 . . . . 0.0 111.286 179.812 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.482 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -122.76 108.9 13.56 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.437 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.505 ' CE2' HG22 ' A' ' 30' ' ' THR . 9.3 p-90 37.49 -159.32 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.098 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.505 HG22 ' CE2' ' A' ' 29' ' ' TRP . 3.0 p 65.4 157.37 0.1 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.737 0.303 . . . . 0.0 110.592 -179.216 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 31.4 p90 -136.72 175.38 9.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.092 -179.812 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.7 t -98.38 -73.58 0.61 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.987 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -179.59 -51.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.868 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -90.0 136.7 32.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.881 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -69.74 -6.73 33.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.807 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -89.96 -19.21 24.76 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.879 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -131.22 141.53 50.05 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.892 0.377 . . . . 0.0 110.801 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.36 158.59 23.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.835 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 9.8 t -89.99 80.76 6.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.815 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.465 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.0 OUTLIER -65.3 171.23 3.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.779 179.955 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.41 ' N ' ' HB3' ' A' ' 27' ' ' MET . 7.7 tp10 -63.86 120.72 12.45 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.061 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.593 ' HA ' HG23 ' A' ' 15' ' ' VAL . 2.9 p90 . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.235 -0.888 . . . . 0.0 112.045 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 3.5 pt . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.851 0.358 . . . . 0.0 111.129 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -132.0 29.65 4.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.926 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 20.6 p90 173.73 -35.94 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.872 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.36 85.26 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.841 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -44.12 -74.45 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.562 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 35.6 mtm -85.44 -165.02 1.1 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.787 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 172.57 172.45 0.11 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.793 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.36 176.44 0.25 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.133 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.2 p -111.11 29.68 7.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.969 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 9.3 m0 -54.55 -31.97 57.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.18 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.0 t -97.45 -57.92 2.13 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.987 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.537 ' CB ' HG21 ' A' ' 30' ' ' THR . 21.3 t-80 -57.85 -26.8 62.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.054 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.97 163.46 0.1 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.935 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 164.88 174.46 34.63 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.556 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.431 HG23 ' HA ' ' A' ' 42' ' ' TYR . 21.5 t -91.94 105.66 16.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.854 0.359 . . . . 0.0 111.122 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.9 t -79.02 96.09 5.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.84 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.2 -164.3 1.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.888 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 77.1 m-20 -74.46 138.55 43.32 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.86 0.362 . . . . 0.0 111.214 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.405 ' HA ' ' HG2' ' A' ' 38' ' ' LYS . 0.7 OUTLIER -52.52 -29.25 24.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.2 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.0 t -103.87 33.45 3.42 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.002 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 8.6 tt0 -65.44 133.99 52.48 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 121.287 0.565 . . . . 0.0 110.641 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.65 14.73 7.89 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.404 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.18 38.5 0.72 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.001 0.429 . . . . 0.0 110.39 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.98 154.51 19.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.17 -179.48 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.441 ' CB ' ' CD ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -105.54 179.08 0.98 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.876 -179.896 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.441 ' CD ' ' CB ' ' A' ' 25' ' ' LYS . 33.1 Cg_exo -59.91 80.22 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.514 2.143 . . . . 0.0 112.402 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.404 ' CB ' ' HA ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -55.84 164.03 1.27 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.05 179.932 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -124.78 177.55 5.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.059 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 65.7 p-90 -47.55 -29.91 3.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.397 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.537 HG21 ' CB ' ' A' ' 12' ' ' HIS . 20.0 p -65.48 151.99 45.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.907 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 28.4 p90 -137.06 -179.14 5.53 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.887 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.5 t -89.92 -66.29 0.94 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.828 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 178.53 -56.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.66 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -89.98 150.16 22.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.742 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -69.15 -8.03 41.73 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.933 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -89.76 -19.79 24.32 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.003 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 58.6 mm-40 -125.76 131.6 52.48 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.774 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.405 ' HG2' ' HA ' ' A' ' 19' ' ' LYS . 5.2 ptpt -117.3 153.56 32.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.154 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.9 t -96.33 94.63 7.56 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.609 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.404 ' HA ' ' CB ' ' A' ' 27' ' ' MET . 0.8 OUTLIER -76.9 177.19 7.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.082 -179.816 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.81 115.94 11.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.886 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.431 ' HA ' HG23 ' A' ' 15' ' ' VAL . 15.6 p90 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.227 -0.892 . . . . 0.0 112.118 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 1.6 pt . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.863 0.364 . . . . 0.0 111.101 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 40.9 mtp -150.97 138.22 19.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.889 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 4.2 t80 60.76 64.77 1.11 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.843 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -121.64 -40.32 2.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.925 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 56.27 95.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.864 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 3.5 mmt -101.54 175.16 5.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.869 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 175.99 170.72 0.39 Allowed 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.833 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.4 ' HB3' ' CD1' ' A' ' 10' ' ' TRP . . . -68.45 -172.93 0.38 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.049 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.2 p -117.1 24.85 10.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.993 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.4 ' CD1' ' HB3' ' A' ' 8' ' ' ALA . 7.8 m95 -57.36 -27.3 62.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.142 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.7 t -89.94 -32.88 16.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.969 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -80.03 -29.62 39.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.845 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.6 m 62.12 84.31 0.14 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.913 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -113.82 -145.39 9.1 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.837 -0.696 . . . . 0.0 112.477 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.494 HG23 ' HA ' ' A' ' 42' ' ' TYR . 21.4 t -131.13 102.65 6.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.822 0.344 . . . . 0.0 111.082 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.9 t -79.81 103.27 9.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.952 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.12 -165.48 1.37 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.66 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.479 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 9.0 t70 -71.27 136.53 47.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.962 0.411 . . . . 0.0 110.972 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.423 ' HA ' ' HG2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -49.97 -36.35 27.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.027 0.441 . . . . 0.0 111.049 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.6 t -101.43 31.85 3.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.966 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.479 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 7.6 tp10 -61.94 129.95 43.33 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.214 0.531 . . . . 0.0 110.447 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.6 16.2 4.07 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.632 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -150.18 40.19 0.78 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.99 0.424 . . . . 0.0 110.374 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.85 147.79 23.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.215 -179.358 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.466 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 0.1 OUTLIER -98.2 172.08 5.2 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.638 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.466 ' HD2' ' HB3' ' A' ' 25' ' ' LYS . 45.3 Cg_exo -57.11 83.38 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.447 2.098 . . . . 0.0 112.541 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.553 ' HE2' ' HD3' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -54.67 168.19 0.3 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.253 179.917 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -120.26 173.17 7.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.867 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.634 ' CH2' HG22 ' A' ' 30' ' ' THR . 46.6 p-90 -47.07 -29.02 1.93 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.408 -179.741 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.634 HG22 ' CH2' ' A' ' 29' ' ' TRP . 44.3 p -65.33 165.1 12.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.087 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -135.39 -179.41 5.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.842 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 49.0 t -93.39 -78.65 0.42 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.007 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -179.49 -51.44 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.01 -179.935 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -89.87 144.27 26.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.888 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -66.75 -12.06 57.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.686 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -90.07 -22.63 21.72 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.126 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -128.06 138.55 52.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.79 0.329 . . . . 0.0 111.059 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.553 ' HD3' ' HE2' ' A' ' 27' ' ' MET . 0.0 OUTLIER -123.28 158.36 31.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.043 -179.903 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 33.9 t -90.52 113.67 25.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.957 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -98.51 179.45 4.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.788 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.408 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -63.9 127.26 30.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.786 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.494 ' HA ' HG23 ' A' ' 15' ' ' VAL . 29.0 p90 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.232 -0.889 . . . . 0.0 112.17 -179.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 11.3 pt . . . . . 0 N--CA 1.485 1.299 0 CA-C-O 120.866 0.365 . . . . 0.0 111.132 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 22.9 mtm -110.75 128.46 55.74 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.853 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 1.5 t80 177.93 -50.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.857 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -80.0 115.74 19.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.895 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -43.42 -51.55 6.49 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.542 -179.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 8.8 mmm -78.91 179.59 7.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.894 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 168.42 155.03 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.795 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.81 166.67 2.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.021 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 29.3 p -105.09 20.06 19.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.25 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -57.52 -27.99 63.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.762 0.315 . . . . 0.0 111.092 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.9 t -90.09 -64.6 1.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.951 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.5 -23.93 59.22 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.154 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 66.21 147.85 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.931 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -171.35 -164.68 27.43 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.526 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.5 t -115.96 95.97 4.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.814 0.34 . . . . 0.0 111.148 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.4 t -72.02 95.84 1.65 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.778 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.4 -168.04 1.99 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.774 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -74.9 136.78 41.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.8 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.7 mttm -53.83 -28.06 33.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.918 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 29.3 t -105.31 34.53 3.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.739 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -73.22 149.29 42.95 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.297 0.57 . . . . 0.0 110.616 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -98.65 17.57 18.89 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.127 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -148.01 28.93 0.91 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.833 0.349 . . . . 0.0 110.682 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.35 147.47 23.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.995 -179.627 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.443 ' HB3' ' HB3' ' A' ' 41' ' ' GLU . 1.1 mptp? -101.07 177.54 1.49 Allowed Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.747 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.411 ' CD ' ' CB ' ' A' ' 25' ' ' LYS . 47.5 Cg_exo -56.67 82.86 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.434 2.089 . . . . 0.0 112.525 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.406 ' N ' ' O ' ' A' ' 25' ' ' LYS . 5.5 ppp? -52.82 164.42 0.38 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.299 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -124.49 174.53 7.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.051 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.471 ' CH2' HG22 ' A' ' 30' ' ' THR . 55.2 p-90 -49.16 -30.66 7.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.287 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.471 HG22 ' CH2' ' A' ' 29' ' ' TRP . 13.2 p -58.66 158.24 8.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.899 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -129.46 172.38 11.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.859 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 40.8 t -90.03 -73.78 0.51 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.937 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -179.13 -49.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.736 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -89.97 140.91 29.17 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.787 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -70.53 -6.98 40.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.946 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -89.91 -14.03 35.05 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.17 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.41 161.59 35.03 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.801 0.334 . . . . 0.0 110.787 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -130.54 162.53 29.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.113 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.6 t -99.91 104.77 16.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.86 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 m -81.31 176.87 9.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.737 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.443 ' HB3' ' HB3' ' A' ' 25' ' ' LYS . 0.3 OUTLIER -71.05 116.62 11.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.717 179.908 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 1.8 p90 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.245 -0.884 . . . . 0.0 112.198 -179.512 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 4.6 tp . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 120.748 0.308 . . . . 0.0 111.083 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.95 -42.23 5.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.884 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -179.89 -39.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.891 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -171.3 -58.09 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.864 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.407 ' O ' ' CE3' ' A' ' 29' ' ' TRP . 0.6 OUTLIER 177.83 88.58 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.73 179.662 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 72.3 mtp -102.26 152.23 21.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.16 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.451 ' N ' ' CE2' ' A' ' 31' ' ' TYR . 0.0 OUTLIER 174.58 157.62 0.16 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.723 179.728 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.79 156.81 10.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.235 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.6 p -115.1 25.8 10.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.966 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 11.8 m0 -55.45 -38.44 69.05 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.131 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -108.26 30.35 6.49 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.046 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.8 m80 -147.36 21.21 1.2 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.146 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 53.25 178.84 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.781 0.324 . . . . 0.0 111.025 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 145.42 171.79 15.32 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.615 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.4 t -120.19 85.12 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.837 0.351 . . . . 0.0 111.074 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.7 t -61.69 94.78 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.976 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.58 -163.63 0.92 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.624 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -88.59 137.73 32.06 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.738 0.304 . . . . 0.0 110.897 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.1 mtpp -50.86 -30.77 15.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.913 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.9 t -99.23 25.12 7.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.851 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -60.51 118.26 6.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.087 0.47 . . . . 0.0 110.565 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.29 12.31 18.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.558 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -150.08 40.13 0.78 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.169 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -98.84 179.17 4.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.609 -179.181 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.7 mmtt -115.18 164.69 16.13 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.289 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -50.52 90.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.483 2.122 . . . . 0.0 112.651 -179.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.42 ' CB ' ' HA ' ' A' ' 40' ' ' CYS . 0.1 OUTLIER -60.15 168.54 1.91 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.98 179.727 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -122.26 174.3 7.07 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.931 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.763 ' CH2' HG22 ' A' ' 30' ' ' THR . 37.5 p-90 -49.38 -26.76 3.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.451 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.763 HG22 ' CH2' ' A' ' 29' ' ' TRP . 15.7 p -66.94 157.92 32.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.85 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.451 ' CE2' ' N ' ' A' ' 7' ' ' GLN . 15.1 p90 -137.37 177.51 7.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.967 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 4.1 t -89.92 -67.37 0.85 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.986 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -179.45 -53.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.701 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 55.3 t30 -90.0 152.44 21.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.751 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -66.79 -11.55 55.52 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.824 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -90.01 -22.64 21.78 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.082 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -114.87 134.35 55.21 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.753 0.311 . . . . 0.0 110.992 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.415 ' NZ ' ' HG2' ' A' ' 27' ' ' MET . 0.0 OUTLIER -122.63 154.82 37.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.121 179.976 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 9.0 t -87.5 99.28 11.91 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.589 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.42 ' HA ' ' CB ' ' A' ' 27' ' ' MET . 0.7 OUTLIER -79.83 174.84 11.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.302 -179.548 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -58.13 106.77 0.4 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.005 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 10.5 p90 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.235 -0.888 . . . . 0.0 112.053 -179.584 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.562 ' O ' HG23 ' A' ' 1' ' ' ILE . 11.3 tt . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.895 0.379 . . . . 0.0 111.101 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.1 ptt? -140.8 -57.96 0.51 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.892 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -55.99 -171.94 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.22 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -154.39 142.87 20.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.839 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 54.68 69.68 0.7 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.081 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 30.6 mmm -101.56 -166.82 1.34 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.752 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 169.94 179.82 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.817 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.515 ' HB3' ' NE1' ' A' ' 10' ' ' TRP . . . -100.51 -177.21 3.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.133 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 27.3 p -109.89 27.77 9.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.0 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.515 ' NE1' ' HB3' ' A' ' 8' ' ' ALA . 9.7 m95 -54.49 -31.25 55.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.033 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.4 t -97.3 -52.2 3.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.849 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -59.62 -25.95 65.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.945 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.5 p 63.32 143.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.974 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -165.87 -134.48 1.68 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.5 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.436 ' CG2' ' HA ' ' A' ' 42' ' ' TYR . 21.8 t -141.06 82.02 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.859 0.362 . . . . 0.0 111.068 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.0 t -66.37 89.32 0.14 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.808 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.18 -166.26 1.2 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.738 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.66 136.23 41.92 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.825 0.345 . . . . 0.0 110.91 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.4 mttt -63.53 -34.95 78.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.653 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.1 t -104.79 34.76 3.02 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.41 179.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.85 -175.63 3.55 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.351 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -123.04 17.96 10.04 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.496 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.02 40.0 0.78 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.88 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -97.14 146.97 24.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.039 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.491 ' CB ' ' HD2' ' A' ' 26' ' ' PRO . 1.0 OUTLIER -106.15 170.83 5.37 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.763 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.491 ' HD2' ' CB ' ' A' ' 25' ' ' LYS . 9.5 Cg_endo -52.49 87.72 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.393 2.062 . . . . 0.0 112.246 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.402 ' N ' ' O ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -62.46 165.77 5.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.137 -179.902 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -115.13 177.69 4.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.012 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 64.1 p-90 -49.97 -36.18 27.19 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.292 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 19.1 p -58.92 148.78 29.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.967 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 16.8 p90 -130.68 179.96 5.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.917 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.5 t -94.43 -69.5 0.75 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.892 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.4 pp20? 178.54 -46.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.862 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -96.66 146.87 24.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.862 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -69.14 -8.3 44.24 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.871 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -89.8 -19.28 24.88 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.059 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -129.39 141.12 51.14 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.812 0.339 . . . . 0.0 110.853 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -131.78 158.06 42.22 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.095 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 17.8 t -86.26 93.15 8.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.591 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -82.07 166.41 19.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.975 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.88 139.23 52.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.935 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.436 ' HA ' ' CG2' ' A' ' 15' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.237 -0.887 . . . . 0.0 112.277 -179.587 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 8.9 tp . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.787 0.327 . . . . 0.0 111.065 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 4.1 mmt -133.18 133.84 43.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.883 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 60.13 40.1 18.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.913 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -164.67 -163.34 0.72 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.876 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 179.28 98.21 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 120.893 0.377 . . . . 0.0 110.915 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 8.3 mtt -70.25 -173.19 0.66 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.88 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 178.05 -172.45 0.12 Allowed 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.924 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.59 157.29 35.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.254 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.5 p -107.89 25.45 11.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.97 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 18.1 m0 -55.99 -32.1 63.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.256 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.0 t -89.98 -34.3 16.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.962 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -70.0 -16.42 63.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.276 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 67.34 126.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.859 0.361 . . . . 0.0 110.929 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -172.87 -167.8 33.3 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.825 -0.703 . . . . 0.0 112.288 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.424 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 24.4 t -122.84 95.16 3.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.967 0.413 . . . . 0.0 111.166 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.7 t -62.51 86.25 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.894 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.38 -163.21 1.02 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.765 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -96.07 142.01 28.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.842 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.16 -40.69 90.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.894 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.7 t -73.42 -11.89 60.62 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.136 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -102.62 95.14 6.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.829 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.43 ' CD ' ' N ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -97.67 40.29 1.17 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.967 -179.794 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -98.35 24.76 6.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.96 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -121.69 -173.73 2.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.683 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.26 155.4 84.14 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.645 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -64.16 103.33 0.42 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.418 2.079 . . . . 0.0 112.328 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 12.6 ptm -60.81 163.62 5.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.129 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.437 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -134.41 104.76 6.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.824 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.437 ' CD1' ' O ' ' A' ' 28' ' ' ALA . 0.5 OUTLIER 47.75 -178.71 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.418 -179.815 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 63.37 161.72 0.1 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.633 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -139.32 -178.86 5.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.945 0.402 . . . . 0.0 111.229 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 36.1 t -89.84 -64.03 1.2 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.762 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -178.47 -44.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.679 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 60.5 t30 -107.89 150.49 26.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.663 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -69.85 -7.0 36.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.926 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -89.74 -17.83 27.51 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.965 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -119.13 149.34 41.87 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.817 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -121.52 162.43 20.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.952 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 15.4 t -95.82 83.21 3.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.825 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.424 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -55.7 154.04 7.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.668 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.65 107.99 5.43 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.059 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 28.4 p90 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.079 -179.6 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.505 ' O ' HG23 ' A' ' 1' ' ' ILE . 1.2 tp . . . . . 0 N--CA 1.487 1.424 0 CA-C-O 120.815 0.341 . . . . 0.0 111.232 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 6.9 mmt -126.16 146.53 49.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.898 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 5.8 t80 60.34 79.13 0.25 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.895 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -112.27 151.0 30.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.931 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -43.28 -32.98 0.88 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.42 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 40.2 mtt -75.73 -174.36 2.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.869 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 175.53 160.41 0.25 Allowed 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.918 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.37 153.66 40.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.184 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.5 p -113.81 19.6 16.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.18 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 50.3 m0 -56.51 -44.74 81.04 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.831 0.348 . . . . 0.0 111.082 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.85 -20.21 23.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.239 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 13.0 m-70 -96.18 24.28 5.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.069 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.0 t 56.95 179.95 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.989 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 139.24 166.0 10.45 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.476 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.486 HG23 ' HA ' ' A' ' 42' ' ' TYR . 21.2 t -116.1 87.86 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.868 0.366 . . . . 0.0 111.17 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 49.5 t -67.05 99.69 0.68 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.939 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.51 -164.65 1.12 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.603 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -83.1 138.3 33.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.824 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.1 mttm -49.76 -29.81 8.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.949 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.8 t -103.4 28.17 6.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.711 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 -60.63 117.52 5.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.715 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.76 12.92 13.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.446 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -149.29 42.67 0.93 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.204 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -104.21 173.18 6.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.479 -179.112 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -104.34 168.13 8.98 Favored Pre-proline 0 C--N 1.332 -0.189 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.546 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.78 93.57 0.32 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.48 2.12 . . . . 0.0 112.545 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.482 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 3.5 ptm -59.24 168.77 1.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.38 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.49 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -147.95 109.42 4.37 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.02 179.357 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.983 ' CE2' HG23 ' A' ' 30' ' ' THR . 2.8 p-90 38.58 -159.1 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.277 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.983 HG23 ' CE2' ' A' ' 29' ' ' TRP . 2.1 p 51.73 -179.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.864 0.364 . . . . 0.0 111.294 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.2 p90 -154.69 179.59 8.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.733 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 41.1 t -90.29 -72.72 0.55 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.797 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -178.61 -39.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.711 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -107.5 147.91 29.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.775 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.3 mmp_? -67.98 -8.79 40.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.983 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -89.82 -22.2 22.21 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.003 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -123.45 144.04 49.76 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.803 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -122.09 157.11 32.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.185 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 16.9 t -85.53 117.41 24.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.547 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.482 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.6 OUTLIER -96.57 176.6 5.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.328 -179.544 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.93 105.2 2.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.965 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.486 ' HA ' HG23 ' A' ' 15' ' ' VAL . 1.7 p90 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.224 -0.893 . . . . 0.0 112.084 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 2.6 pt . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.786 0.327 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -176.7 149.48 0.76 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.927 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 63.15 145.41 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.885 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -167.57 83.08 0.21 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.858 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -43.44 -34.64 1.36 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.561 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.441 ' HB3' ' CD2' ' A' ' 31' ' ' TYR . 6.0 mmt -83.38 -178.36 7.04 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.974 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.759 ' O ' HG22 ' A' ' 30' ' ' THR . 6.3 tp60 177.76 159.63 0.47 Allowed 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.771 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.6 147.33 32.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.048 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 15.1 p -95.08 18.61 11.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.216 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 20.4 m0 -57.33 -42.93 82.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.818 0.342 . . . . 0.0 111.013 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.38 -20.36 22.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.278 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -95.39 23.26 6.07 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.267 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.6 m 57.78 -168.46 0.12 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.033 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.402 ' N ' ' HB3' ' A' ' 42' ' ' TYR . . . 116.72 156.84 10.74 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.304 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.476 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 34.4 t -112.64 85.93 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.965 0.412 . . . . 0.0 111.07 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 46.4 t -57.56 100.64 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.178 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -119.27 -159.72 0.78 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.468 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -84.88 144.27 28.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.912 0.386 . . . . 0.0 110.967 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.6 mmtm -49.09 -27.35 3.31 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.244 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.41 ' O ' ' CD ' ' A' ' 22' ' ' ARG . 12.4 t -94.1 29.77 2.06 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.743 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.58 114.28 2.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.987 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.41 ' CD ' ' O ' ' A' ' 20' ' ' SER . 0.0 OUTLIER -115.64 19.15 15.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.194 179.839 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -123.38 -32.12 3.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.705 0.288 . . . . 0.0 111.392 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.7 -171.3 3.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.828 0.347 . . . . 0.0 110.893 -179.623 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.3 mtpt -98.33 167.69 11.12 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.93 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -66.9 123.16 10.64 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.535 2.156 . . . . 0.0 112.311 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.5 153.66 15.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.002 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -130.94 102.23 5.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.919 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.412 ' CD1' ' OG1' ' A' ' 30' ' ' THR . 0.0 OUTLIER 54.28 173.29 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.814 -179.858 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.759 HG22 ' O ' ' A' ' 7' ' ' GLN . 0.2 OUTLIER 67.02 162.9 0.18 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.549 -179.459 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.441 ' CD2' ' HB3' ' A' ' 6' ' ' MET . 8.0 p90 -135.56 169.63 17.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.965 0.412 . . . . 0.0 110.948 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 41.1 t -89.92 -64.14 1.18 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.782 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -178.38 -49.16 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.643 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -106.75 148.61 28.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.684 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -69.25 -7.34 35.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.927 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -89.95 -19.31 24.65 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.112 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 9.5 mp0 -109.8 148.24 31.83 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.833 0.349 . . . . 0.0 111.03 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.5 132.4 53.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.857 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.6 t -77.87 97.3 5.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.992 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.476 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -57.47 154.26 11.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.761 179.85 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -57.96 110.0 0.84 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.995 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.402 ' HB3' ' N ' ' A' ' 14' ' ' GLY . 13.9 p90 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.231 -0.89 . . . . 0.0 112.045 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 30.1 mm . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.832 0.348 . . . . 0.0 111.079 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.95 -64.93 1.18 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.804 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 16.7 t80 60.81 88.15 0.08 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.944 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -105.12 115.23 29.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.853 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -43.58 -56.57 3.62 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.614 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 3.9 mtp -156.33 -68.32 0.11 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.994 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 65.61 -176.16 0.18 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.837 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.44 ' HB3' ' CD1' ' A' ' 10' ' ' TRP . . . -96.71 -179.55 4.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.202 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.5 p -114.47 26.24 10.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.942 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.44 ' CD1' ' HB3' ' A' ' 8' ' ' ALA . 14.8 m95 -55.91 -47.63 77.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.078 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 47.4 t -98.23 30.96 2.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.94 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -145.49 29.43 1.14 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.806 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.8 m 58.35 -176.12 0.08 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.933 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 110.97 156.5 14.36 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.485 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.491 HG22 ' CE1' ' A' ' 42' ' ' TYR . 15.9 t -122.07 114.84 44.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.868 0.366 . . . . 0.0 111.135 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 37.5 t -70.08 87.03 0.56 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.954 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.75 -161.84 0.77 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.538 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -83.71 140.59 32.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.835 0.35 . . . . 0.0 110.827 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.47 -33.64 14.81 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.109 0.48 . . . . 0.0 111.075 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.6 t -100.33 27.0 6.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.943 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.417 ' CG ' ' HB2' ' A' ' 24' ' ' CYS . 4.2 tp10 -57.37 113.75 1.9 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.987 0.422 . . . . 0.0 110.671 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.62 23.83 7.37 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.403 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -138.73 8.37 2.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.603 -0.272 . . . . 0.0 111.706 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.417 ' HB2' ' CG ' ' A' ' 21' ' ' GLU . 0.5 OUTLIER -131.53 167.11 19.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.587 0.232 . . . . 0.0 110.809 -179.695 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 18.0 mmtt -81.13 161.1 63.99 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 120.778 0.323 . . . . 0.0 110.96 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -57.86 124.26 15.58 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.624 2.216 . . . . 0.0 112.436 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -57.68 164.14 2.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.228 -179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.457 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -125.37 98.58 5.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.636 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.505 ' CE2' ' CG2' ' A' ' 30' ' ' THR . 7.0 p-90 36.87 -159.7 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.068 -0.514 . . . . 0.0 112.035 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.505 ' CG2' ' CE2' ' A' ' 29' ' ' TRP . 2.5 p 61.82 174.79 0.12 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.687 0.28 . . . . 0.0 110.406 -179.007 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 5.9 p90 -141.56 152.49 44.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.949 0.404 . . . . 0.0 111.122 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.3 t -89.85 -56.09 3.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.777 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -176.23 -46.38 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.563 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -109.4 151.53 26.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.639 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -67.58 -10.17 49.52 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 120.861 0.362 . . . . 0.0 111.789 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -91.17 -21.45 21.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.072 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -89.56 146.72 24.39 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.778 0.323 . . . . 0.0 111.069 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 8.0 ptpt -125.42 149.44 48.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.997 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 41.8 t -91.78 76.07 5.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.8 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 12.7 t -43.9 157.65 0.05 Allowed 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.388 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -95.46 102.09 13.86 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.822 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.491 ' CE1' HG22 ' A' ' 15' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.227 -0.892 . . . . 0.0 112.297 -179.634 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.579 ' O ' HG23 ' A' ' 1' ' ' ILE . 14.6 tt . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.973 0.416 . . . . 0.0 111.053 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -101.52 -53.67 2.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.888 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 33.9 p90 -48.36 162.77 0.08 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.255 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -130.52 116.9 18.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.898 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 178.21 -42.34 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.921 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.417 ' O ' ' HB2' ' A' ' 7' ' ' GLN . 35.4 mtp -88.26 -175.94 5.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.903 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 6' ' ' MET . 15.9 tt0 177.36 155.93 0.31 Allowed 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.788 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.46 161.34 9.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.179 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 3.8 p -120.16 10.27 11.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.213 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 16.9 m0 -54.59 -47.49 73.27 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.894 0.378 . . . . 0.0 111.103 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.68 31.12 6.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.837 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -138.29 38.9 2.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.906 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 52.0 m 61.95 115.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.936 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 156.97 149.17 5.32 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.531 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.8 t -126.58 94.86 2.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.893 0.378 . . . . 0.0 111.186 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 51.0 t -58.32 105.69 0.31 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.019 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.96 -166.54 1.18 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.809 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -89.07 133.48 34.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.887 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.34 -30.35 68.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.002 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 46.5 t -91.75 16.96 9.67 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.345 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -100.55 -42.51 6.53 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.732 0.301 . . . . 0.0 110.95 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 40.49 41.09 1.0 Allowed 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.869 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -110.94 13.57 22.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.13 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.4 t -132.43 178.64 6.67 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.788 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.403 ' CB ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -67.16 168.44 11.28 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.781 179.935 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.403 ' HD2' ' CB ' ' A' ' 25' ' ' LYS . 51.0 Cg_endo -69.4 119.31 6.29 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.531 2.154 . . . . 0.0 112.505 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.405 ' HG2' ' N ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -50.21 142.53 9.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.173 179.895 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.469 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -117.54 102.72 9.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.691 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.553 ' CE2' HG22 ' A' ' 30' ' ' THR . 5.9 p-90 36.79 -158.15 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.965 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.553 HG22 ' CE2' ' A' ' 29' ' ' TRP . 3.0 p 64.76 176.86 0.19 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.74 0.305 . . . . 0.0 110.59 -179.213 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.416 ' CE2' ' N ' ' A' ' 7' ' ' GLN . 6.7 p90 -140.39 153.13 46.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.07 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 38.0 t -97.84 -72.01 0.66 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.726 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -176.83 -48.82 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.751 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -103.19 138.13 40.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.752 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.4 mmp_? -68.52 -6.99 28.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.792 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -98.18 12.92 33.01 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.186 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 63.2 mm-40 -126.87 162.12 26.67 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.866 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -133.22 129.2 37.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.961 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.7 t -76.91 89.89 3.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.038 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.4 t -46.2 156.0 0.18 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.12 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -123.66 56.32 1.22 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.931 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 2.3 p90 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.22 -0.895 . . . . 0.0 112.095 -179.505 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 3.7 mp . . . . . 0 N--CA 1.485 1.287 0 CA-C-O 120.868 0.366 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 58.7 23.8 11.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.077 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 1.8 t80 177.23 150.68 0.18 Allowed 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.851 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -121.49 -77.27 0.58 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.83 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.412 ' O ' ' CG ' ' A' ' 5' ' ' GLU . 14.3 tt0 47.83 28.31 1.32 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.289 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.1 mtp -153.16 177.35 10.92 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.015 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.477 ' O ' HG22 ' A' ' 30' ' ' THR . 4.8 mt-30 166.8 170.58 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.726 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.454 ' CB ' ' CD1' ' A' ' 10' ' ' TRP . . . -59.69 151.35 25.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.061 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 27.6 p -96.96 23.95 6.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.259 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.454 ' CD1' ' CB ' ' A' ' 8' ' ' ALA . 15.8 m95 -55.89 -36.22 67.41 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.865 0.364 . . . . 0.0 110.971 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 t -89.99 -44.33 9.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.793 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.62 -27.77 69.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.89 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.1 p 63.8 137.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.017 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -169.47 -159.24 14.73 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.271 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.428 ' O ' ' HB2' ' A' ' 40' ' ' CYS . 25.1 t -128.23 83.87 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.951 0.405 . . . . 0.0 111.212 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.4 t -58.8 95.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.934 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.02 -161.89 0.99 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.812 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.403 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 0.2 OUTLIER -83.74 137.64 33.65 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.889 0.375 . . . . 0.0 110.832 179.992 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -50.71 -27.33 6.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.057 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.1 t -99.56 27.06 5.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.1 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.423 ' HB3' ' HB2' ' A' ' 24' ' ' CYS . 21.7 tp10 -60.4 118.5 6.54 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 121.012 0.434 . . . . 0.0 110.383 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.61 13.1 14.87 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.79 -179.154 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -150.26 43.96 0.87 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.904 0.383 . . . . 0.0 110.519 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.423 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 0.1 OUTLIER -116.63 -178.58 3.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.587 -178.983 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.72 166.7 15.68 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.602 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.02 109.23 2.84 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.58 2.187 . . . . 0.0 112.714 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.468 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -75.3 171.81 13.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.329 179.825 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.487 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -127.47 110.02 12.34 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.496 179.68 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.689 ' CZ2' HG23 ' A' ' 30' ' ' THR . 2.2 p-90 41.91 -167.43 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.869 -179.587 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.689 HG23 ' CZ2' ' A' ' 29' ' ' TRP . 0.2 OUTLIER 56.61 167.44 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.749 -179.231 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 46.7 p90 -140.24 179.17 6.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.926 0.394 . . . . 0.0 111.201 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 30.9 t -89.94 -71.45 0.61 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.691 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -179.47 -56.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.68 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 31.4 t-20 -90.27 141.82 28.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.658 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.3 mmp_? -68.16 -7.3 28.86 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.277 -0.419 . . . . 0.0 112.022 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -89.71 -22.74 22.07 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.801 179.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -124.7 139.15 54.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.685 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.67 143.7 45.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.054 -179.759 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 8.2 t -75.9 105.0 6.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.611 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.468 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.3 OUTLIER -72.76 177.74 4.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.23 -179.817 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.94 118.8 22.02 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.913 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 27.5 p90 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.239 -0.886 . . . . 0.0 112.129 -179.559 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.425 HD12 ' HB2' ' A' ' 2' ' ' MET . 2.5 pp . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.783 0.325 . . . . 0.0 111.099 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.425 ' HB2' HD12 ' A' ' 1' ' ' ILE . 2.1 tpt 60.93 94.41 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.926 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 60.64 97.63 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.865 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -164.54 133.56 3.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.852 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -43.51 -31.44 0.72 Allowed 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.613 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 6.8 mtt -77.76 -179.61 6.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.945 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 167.92 158.26 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.732 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.56 166.65 5.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.103 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 31.8 p -103.55 18.27 22.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.244 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 8.7 m95 -57.41 -31.99 66.41 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.865 0.364 . . . . 0.0 111.135 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 t -89.86 -42.2 11.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.872 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -68.43 -25.33 64.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.945 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.6 t 64.47 118.21 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.926 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -153.23 -157.57 8.12 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.456 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 31.1 t -128.15 94.07 2.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.809 0.338 . . . . 0.0 111.072 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.1 t -72.86 96.7 2.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.723 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.61 -162.21 0.86 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.666 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -77.72 137.1 38.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.762 0.315 . . . . 0.0 110.811 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -48.43 -28.4 3.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.143 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.5 t -96.89 29.89 2.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.802 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.407 ' HG3' ' N ' ' A' ' 24' ' ' CYS . 6.3 tp10 -57.9 118.76 5.69 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.735 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -83.28 7.48 16.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.786 -179.585 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -146.54 40.69 1.11 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.962 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.407 ' N ' ' HG3' ' A' ' 21' ' ' GLU . 0.1 OUTLIER -91.25 154.22 19.43 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.554 -178.955 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.8 mttt -107.85 158.79 32.57 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.774 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -67.78 90.86 0.36 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.546 2.164 . . . . 0.0 112.631 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.452 ' HB2' ' HA ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -70.3 168.8 15.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.286 179.757 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.483 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -118.15 106.12 12.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.138 179.451 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.503 ' CE2' HG22 ' A' ' 30' ' ' THR . 10.0 p-90 38.4 -160.11 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.907 -179.495 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.503 HG22 ' CE2' ' A' ' 29' ' ' TRP . 2.7 p 64.89 169.12 0.19 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.737 0.303 . . . . 0.0 110.555 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 38.1 p90 -141.81 174.66 10.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.026 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 35.4 t -89.9 -78.03 0.38 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.833 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 179.92 -54.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.707 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -89.9 139.66 30.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.786 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -67.96 -8.09 34.18 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.806 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 44.0 t-20 -89.98 -22.83 21.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.925 179.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -127.69 147.23 50.38 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.775 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.14 149.06 50.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.177 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.5 t -80.06 127.4 32.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.681 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.452 ' HA ' ' HB2' ' A' ' 27' ' ' MET . 0.1 OUTLIER -112.27 169.55 8.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.192 -179.727 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -57.67 129.24 40.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.053 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 21.0 p90 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.208 -0.901 . . . . 0.0 112.073 -179.583 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.489 HG22 ' N ' ' A' ' 2' ' ' MET . 7.8 mt . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.863 0.363 . . . . 0.0 111.105 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.489 ' N ' HG22 ' A' ' 1' ' ' ILE . 0.0 OUTLIER -98.17 119.0 36.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.815 179.909 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 173.01 -34.77 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.918 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.419 ' CD2' ' O ' ' A' ' 4' ' ' PHE . 15.9 p90 -97.25 94.46 7.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.002 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -43.56 -69.58 0.13 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.478 -179.716 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 12.9 mtt -113.42 -178.15 3.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.898 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 168.88 -172.99 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.9 179.725 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.407 ' CB ' ' NE1' ' A' ' 10' ' ' TRP . . . -95.52 162.74 13.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.157 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.2 p -105.74 25.0 11.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.163 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.407 ' NE1' ' CB ' ' A' ' 8' ' ' ALA . 11.1 m95 -55.77 -39.2 70.89 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.879 0.371 . . . . 0.0 111.08 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.5 t -119.12 35.13 4.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.889 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -133.91 28.58 3.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.975 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.1 m 57.79 -175.48 0.07 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.997 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.01 163.45 24.86 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.462 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.413 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 3.1 t -118.2 96.91 4.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.907 0.385 . . . . 0.0 111.109 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 39.9 t -69.78 91.31 0.63 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.886 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.49 -167.04 1.33 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.507 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -111.13 74.75 0.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.868 0.366 . . . . 0.0 110.486 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.8 35.27 11.28 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.182 0.515 . . . . 0.0 109.97 -179.351 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.4 t -88.7 25.49 1.73 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.995 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -67.19 -1.95 5.1 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.625 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.97 10.45 11.78 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-O 120.787 0.327 . . . . 0.0 111.637 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.13 -23.96 0.25 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.309 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.01 -178.02 4.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.807 0.337 . . . . 0.0 111.032 -179.727 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.1 mmmt -87.28 164.07 37.16 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.848 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -60.35 119.67 6.99 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.657 2.238 . . . . 0.0 112.454 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 6.8 ptt? -55.59 169.47 0.32 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.022 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -103.87 179.0 4.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.73 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.74 ' CE2' HG23 ' A' ' 30' ' ' THR . 45.9 p-90 -49.24 -44.67 43.77 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.315 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.74 HG23 ' CE2' ' A' ' 29' ' ' TRP . 74.5 p -58.88 156.43 11.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 9.7 p90 -133.14 -179.23 5.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.926 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.04 -71.73 0.67 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.995 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -178.49 -48.89 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.765 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -89.9 139.55 30.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.918 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -66.13 -11.23 47.81 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.73 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -91.98 -24.03 19.36 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.043 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -97.72 135.69 39.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.833 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.64 143.37 47.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.041 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.3 t -91.31 89.02 7.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.967 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.413 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 2.8 t -50.44 153.86 1.45 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.04 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -102.68 95.2 6.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.828 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 6.2 p90 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.221 -0.895 . . . . 0.0 112.226 -179.564 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 8.5 pt . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.966 0.412 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.0 tmm? 61.73 80.76 0.21 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.938 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 60.6 111.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.853 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 12.8 p90 -110.04 135.88 50.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.884 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -43.73 -31.5 0.82 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.557 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 37.8 mmm -69.33 177.98 2.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.008 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.428 ' O ' HG22 ' A' ' 30' ' ' THR . 1.4 mt-30 169.33 -169.98 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.747 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.41 156.14 37.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.107 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.5 p -95.55 22.73 6.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.106 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 15.5 m0 -59.39 -25.46 64.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.302 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.4 t -89.96 -33.53 16.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.995 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -83.76 -25.12 30.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.051 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.4 m 65.82 122.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.945 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -154.22 -161.37 10.41 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.339 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.41 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 29.2 t -116.14 87.09 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.884 0.373 . . . . 0.0 111.103 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.6 t -57.22 91.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.108 -179.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.6 ttt85 -107.27 -158.64 0.66 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.565 179.706 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -93.02 146.79 23.37 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.825 0.345 . . . . 0.0 110.977 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.37 -26.81 8.41 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.03 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.442 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 33.3 t -97.95 32.72 2.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.459 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -61.45 117.07 5.22 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.178 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.442 ' HG3' ' O ' ' A' ' 20' ' ' SER . 0.0 OUTLIER -119.41 16.61 13.01 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.346 179.757 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -125.64 -26.51 3.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.662 0.268 . . . . 0.0 111.568 -179.549 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.71 -176.43 4.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.954 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.49 161.79 38.55 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.94 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -64.42 115.22 3.06 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.502 2.135 . . . . 0.0 112.18 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.79 156.22 11.57 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.067 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.473 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -127.89 105.26 8.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.511 179.64 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.514 ' CH2' HG23 ' A' ' 30' ' ' THR . 1.1 p-90 48.32 -179.74 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.344 -179.53 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.514 HG23 ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER 59.74 167.72 0.07 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.615 -179.308 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 5.6 p90 -144.09 178.31 7.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.146 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 38.6 t -89.89 -65.82 0.98 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.814 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -174.12 -55.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.713 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -91.44 149.87 21.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.694 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -68.6 -9.61 50.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.752 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -91.67 -18.89 23.3 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.223 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -106.26 150.99 25.38 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.853 0.359 . . . . 0.0 111.012 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -131.77 137.3 48.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.901 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.3 t -76.63 92.19 3.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.07 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.41 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 0.0 OUTLIER -58.72 156.55 10.84 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.571 179.831 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -58.06 124.04 17.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.029 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 15.3 p90 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.228 -0.891 . . . . 0.0 112.106 -179.638 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.563 HD11 ' CZ ' ' A' ' 3' ' ' PHE . 16.9 pt . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.828 0.347 . . . . 0.0 111.165 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.3 mtt -89.85 -25.17 21.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.037 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.563 ' CZ ' HD11 ' A' ' 1' ' ' ILE . 1.9 m-85 63.63 149.44 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.917 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.542 ' CD1' ' NE2' ' A' ' 7' ' ' GLN . 1.7 m-85 -98.6 31.43 2.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.96 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -43.55 -32.03 0.85 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.552 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 49.7 mtp -129.22 -178.39 4.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.015 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.542 ' NE2' ' CD1' ' A' ' 4' ' ' PHE . 0.8 OUTLIER 175.24 -167.61 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.661 179.667 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -112.23 176.23 5.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.215 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.5 p -114.43 28.81 8.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.075 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 8.3 m0 -52.67 -28.49 21.88 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.076 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 40.6 t -138.0 34.54 2.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.839 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -120.82 15.61 11.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.263 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 62.52 124.59 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.856 0.36 . . . . 0.0 111.058 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 162.11 164.83 17.9 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.474 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.456 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 1.5 t -112.96 106.04 19.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.854 0.359 . . . . 0.0 111.243 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 46.2 t -81.45 101.08 9.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.944 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.2 ttt85 -144.44 -161.59 1.31 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.756 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.419 ' CB ' ' HB3' ' A' ' 21' ' ' GLU . 1.5 m-20 -70.65 139.87 51.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.907 0.384 . . . . 0.0 110.87 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.472 ' CE ' ' HE2' ' A' ' 27' ' ' MET . 25.4 mtpt -79.33 -55.23 5.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.895 -179.368 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.7 t -82.3 7.97 12.5 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.936 -179.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.419 ' HB3' ' CB ' ' A' ' 18' ' ' ASP . 0.8 OUTLIER -107.67 -72.74 0.71 Allowed 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 120.722 0.296 . . . . 0.0 111.541 -179.575 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.22 156.75 33.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.046 0.451 . . . . 0.0 111.8 -179.341 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -115.82 56.49 0.77 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.155 179.475 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.72 -175.11 4.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.016 -179.461 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.56 167.75 5.15 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.595 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -76.24 105.74 2.13 Favored 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.415 2.077 . . . . 0.0 112.554 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.472 ' HE2' ' CE ' ' A' ' 19' ' ' LYS . 14.5 ptt? -45.75 167.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.056 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -117.1 -177.54 3.23 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.024 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 56.0 p-90 -43.2 -39.24 2.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.354 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 32.4 p -60.18 146.74 42.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.589 179.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -137.71 177.96 7.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.926 0.393 . . . . 0.0 111.233 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.19 -70.47 0.7 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.794 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -170.74 -39.16 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.626 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -108.38 144.52 35.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.528 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -69.13 -7.75 39.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.303 -0.408 . . . . 0.0 112.002 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -89.84 2.84 54.47 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.38 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -127.23 141.4 51.74 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.742 0.306 . . . . 0.0 110.894 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.454 ' HG2' ' HA ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -116.13 155.36 28.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.079 -179.843 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 11.9 t -104.28 85.0 2.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.389 179.519 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.456 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 5.0 t -42.81 136.27 2.68 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.215 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -86.65 112.73 21.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.897 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.174 -0.917 . . . . 0.0 112.358 -179.535 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 1.9 pt . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.835 0.35 . . . . 0.0 111.133 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 41.6 ttp -79.7 -66.49 0.87 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.933 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -48.15 127.76 12.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.29 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -81.81 108.97 15.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.931 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -43.15 -74.54 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.601 -179.787 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 7.6 mtt -139.1 -173.71 3.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.894 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 173.38 169.83 0.16 Allowed 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.831 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.532 ' HB1' ' CE2' ' A' ' 10' ' ' TRP . . . -72.92 164.53 26.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.141 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 26.5 p -109.5 22.21 16.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.131 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.532 ' CE2' ' HB1' ' A' ' 8' ' ' ALA . 6.3 m95 -57.31 -51.23 70.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.963 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 21.7 t -89.93 7.89 35.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.333 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -111.54 -22.48 11.23 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.754 0.312 . . . . 0.0 111.161 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 66.65 146.37 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.952 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -179.91 -149.62 8.64 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.421 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.736 HG23 ' HA ' ' A' ' 42' ' ' TYR . 21.7 t -142.73 87.66 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.804 0.335 . . . . 0.0 111.0 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 48.0 t -66.42 94.35 0.27 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.652 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.04 -171.5 2.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.674 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.455 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 2.2 m-20 -72.81 135.45 45.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.848 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.402 ' HG2' ' HG2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -59.08 -37.27 76.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.953 179.994 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.1 t -101.95 33.12 3.15 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.893 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.455 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 0.9 OUTLIER -75.06 -174.51 2.29 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.095 179.768 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -123.38 17.4 9.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.507 -179.478 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.08 37.34 0.7 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.833 0.349 . . . . 0.0 110.819 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -95.47 133.18 39.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.087 -179.655 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.5 mmtp -93.32 158.64 36.74 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.854 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -48.04 90.89 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.681 2.254 . . . . 0.0 112.337 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.422 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 2.0 ppp? -54.67 165.4 0.6 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.432 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.465 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -134.81 93.45 3.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.652 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.526 ' CE2' HG22 ' A' ' 30' ' ' THR . 9.5 p-90 37.29 -158.96 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.889 -179.768 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.526 HG22 ' CE2' ' A' ' 29' ' ' TRP . 1.7 p 62.78 -177.02 0.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.793 0.33 . . . . 0.0 110.607 -179.104 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -152.65 160.62 43.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.916 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 41.0 t -89.99 -71.74 0.6 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.815 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -165.42 -68.98 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.899 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -90.04 153.61 20.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.82 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -68.41 -8.57 41.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.991 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -89.87 -20.92 22.84 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.053 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -122.81 128.55 50.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.809 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.402 ' HG2' ' HG2' ' A' ' 19' ' ' LYS . 0.1 OUTLIER -117.24 150.96 37.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.146 -179.82 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.2 t -80.85 83.33 6.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.552 179.67 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.422 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.2 OUTLIER -66.55 176.83 1.75 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.089 -179.696 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -63.72 118.87 8.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.015 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.736 ' HA ' HG23 ' A' ' 15' ' ' VAL . 2.8 p90 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.229 -0.891 . . . . 0.0 112.062 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 2.7 pt . . . . . 0 N--CA 1.485 1.304 0 CA-C-O 120.687 0.28 . . . . 0.0 111.07 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 37.72 -93.45 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.822 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -53.91 106.72 0.2 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.759 0.314 . . . . 0.0 111.143 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -176.9 153.77 1.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.928 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 177.97 61.44 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.703 179.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.6 mtp -141.27 -162.59 1.4 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.756 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 177.72 175.8 0.45 Allowed 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.938 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.56 ' HB3' ' CE3' ' A' ' 10' ' ' TRP . . . -81.77 172.58 13.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.267 -179.881 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.5 p -111.19 23.4 14.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.996 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.56 ' CE3' ' HB3' ' A' ' 8' ' ' ALA . 5.9 m0 -58.3 -19.9 38.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.411 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.8 t -89.71 -51.58 5.44 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.821 0.343 . . . . 0.0 111.227 -179.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -88.82 8.69 27.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.566 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 52.5 -168.04 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.819 0.342 . . . . 0.0 111.077 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 152.11 -166.4 31.0 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.531 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.413 HG23 ' HA ' ' A' ' 42' ' ' TYR . 21.4 t -119.7 92.63 2.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.814 0.34 . . . . 0.0 111.033 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 51.2 t -74.27 101.88 4.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.965 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.64 -163.89 1.44 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.763 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -78.0 136.92 38.04 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.865 0.364 . . . . 0.0 110.955 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.7 mttt -58.48 -27.08 64.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.978 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.6 t -107.09 35.6 2.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.738 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -74.61 168.79 19.09 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 121.132 0.491 . . . . 0.0 110.407 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.08 16.14 16.04 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.492 -179.547 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -150.2 31.51 0.68 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.882 0.372 . . . . 0.0 110.648 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.7 146.65 23.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.115 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.422 ' CB ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -95.96 167.21 12.91 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.81 179.962 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.422 ' HD2' ' CB ' ' A' ' 25' ' ' LYS . 9.5 Cg_endo -50.8 87.82 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.66 2.24 . . . . 0.0 112.417 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.405 ' N ' ' O ' ' A' ' 25' ' ' LYS . 5.4 ppp? -60.48 166.43 3.13 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.207 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -123.3 177.08 5.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.948 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 63.4 p-90 -48.08 -28.85 3.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.248 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 26.6 p -67.88 148.94 50.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.857 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 41.5 p90 -136.21 -177.53 4.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.907 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.81 -70.87 0.64 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.908 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 179.16 -44.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.766 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -90.06 144.04 26.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.863 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -67.21 -10.92 55.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.839 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -89.97 -21.97 22.16 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.139 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 71.2 mm-40 -123.72 143.14 50.46 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.942 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -130.31 160.79 32.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.001 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.8 t -93.37 106.07 18.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.711 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 m -86.2 175.08 8.69 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.958 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.416 ' HB3' ' HB3' ' A' ' 25' ' ' LYS . 2.0 tp10 -63.56 115.87 5.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.947 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.413 ' HA ' HG23 ' A' ' 15' ' ' VAL . 38.3 p90 . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.214 -0.898 . . . . 0.0 112.144 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.564 ' O ' HG23 ' A' ' 1' ' ' ILE . 1.2 tt . . . . . 0 N--CA 1.485 1.306 0 CA-C-O 121.004 0.431 . . . . 0.0 111.039 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 64.63 15.26 9.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.402 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 20.3 p90 172.49 157.97 0.1 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.799 0.333 . . . . 0.0 110.825 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.406 ' O ' ' HB2' ' A' ' 5' ' ' GLU . 27.5 m-85 -127.18 -175.39 3.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.878 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' A' ' 4' ' ' PHE . 0.4 OUTLIER 179.47 -38.89 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.864 179.647 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.3 mtt -59.35 -162.76 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.745 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 175.11 151.64 0.11 Allowed 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 120.828 0.346 . . . . 0.0 110.904 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.93 165.95 8.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.194 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 11.8 p -102.32 28.02 6.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.889 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 18.7 m0 -56.03 -28.78 58.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.203 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.2 t -89.97 -64.4 1.14 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.018 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 64.9 t-80 -57.07 -28.67 62.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.038 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.8 p 62.78 121.54 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.012 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -135.48 -133.27 3.23 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.467 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.419 HG12 ' HD3' ' A' ' 17' ' ' ARG . 21.5 t -144.22 85.52 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.758 0.314 . . . . 0.0 111.236 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.1 t -70.07 96.56 1.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.736 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.419 ' HD3' HG12 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -126.54 -162.92 1.18 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.745 -179.953 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 1.1 m-20 -77.37 132.79 38.73 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.95 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -50.8 -29.54 11.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.972 0.415 . . . . 0.0 110.876 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.0 t -104.22 32.39 4.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.979 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 10.9 tp10 -67.68 140.42 56.8 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.338 0.59 . . . . 0.0 110.295 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.85 14.61 15.02 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.621 -179.294 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -150.35 34.47 0.64 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.822 0.344 . . . . 0.0 110.8 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -94.1 162.62 13.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.321 -179.498 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.44 ' CD ' ' HD2' ' A' ' 26' ' ' PRO . 22.5 mmtm -115.94 164.25 18.36 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.621 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.44 ' HD2' ' CD ' ' A' ' 25' ' ' LYS . 9.1 Cg_endo -50.69 90.25 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.571 2.181 . . . . 0.0 112.572 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.41 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 0.7 OUTLIER -57.0 164.98 1.38 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.19 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -117.69 178.03 4.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.058 179.798 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.5 ' CH2' HG22 ' A' ' 30' ' ' THR . 38.5 p-90 -48.07 -29.75 3.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.344 -179.867 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.5 HG22 ' CH2' ' A' ' 29' ' ' TRP . 29.1 p -58.3 150.41 22.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.034 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -127.18 176.69 7.19 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.916 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 25.7 t -103.31 -67.07 0.9 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.895 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.1 tp10 -178.77 -63.99 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.733 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -89.96 149.82 22.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.796 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.1 mmp_? -67.69 -8.45 35.21 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.079 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 36.4 t-20 -89.66 -23.11 21.97 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.805 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -120.04 130.5 54.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.487 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.91 145.57 47.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.307 -179.802 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.9 t -83.31 97.26 8.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.644 179.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.41 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.8 OUTLIER -71.55 170.44 13.36 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.934 -179.697 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.425 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 2.6 tt0 -93.72 116.9 29.41 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.188 -179.647 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.409 ' C ' ' O ' ' A' ' 41' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.261 -0.876 . . . . 0.0 112.449 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 26.4 mm . . . . . 0 N--CA 1.485 1.3 0 CA-C-O 120.785 0.326 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.8 mtt -114.4 101.47 9.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.883 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 172.41 -40.89 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.798 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 4.0 t80 60.22 110.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.829 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 178.11 -39.04 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.933 179.661 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 7.0 mtt -106.18 178.83 4.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.981 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 168.01 -171.34 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.79 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.43 ' HB2' ' CE1' ' A' ' 31' ' ' TYR . . . -85.17 174.24 9.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.986 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 12.1 m -97.19 21.71 9.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.12 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 9.1 m0 -56.85 -32.77 66.12 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.821 0.344 . . . . 0.0 111.016 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.3 t -97.69 -43.78 7.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.981 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.894 ' CD2' HG21 ' A' ' 30' ' ' THR . 37.2 m-70 -58.1 -31.6 67.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.947 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t 62.33 31.34 17.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.086 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.96 -164.27 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.217 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.493 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 1.1 t -116.74 94.44 3.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.938 0.399 . . . . 0.0 110.994 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.3 t -67.34 106.7 2.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.984 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.7 -158.65 0.65 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.657 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.27 142.41 27.44 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.838 0.351 . . . . 0.0 110.803 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.06 -37.54 69.42 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.889 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.6 t -74.94 -11.47 60.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.131 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -98.81 92.48 5.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.807 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.42 ' CD ' ' N ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -97.06 40.63 1.14 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.893 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.12 -26.84 20.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.968 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.98 177.87 6.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.789 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.53 144.12 92.76 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.747 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -88.18 95.41 0.4 Allowed 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.937 2.424 . . . . 0.0 112.8 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.451 ' HG2' ' NE1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -76.22 100.92 5.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.644 179.628 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -102.46 55.64 0.78 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.011 0.434 . . . . 0.0 111.657 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.851 ' CE3' HG23 ' A' ' 30' ' ' THR . 5.1 p-90 -168.1 -43.6 0.02 OUTLIER 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.481 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.894 HG21 ' CD2' ' A' ' 12' ' ' HIS . 7.7 p -101.33 168.87 9.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.703 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.43 ' CE1' ' HB2' ' A' ' 8' ' ' ALA . 23.2 p90 -140.09 166.06 25.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.191 -179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 35.7 t -89.92 -75.08 0.46 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.937 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -176.0 -46.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.786 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 33.0 t-20 -101.91 145.64 28.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.749 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -69.49 -8.67 48.97 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.868 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 -89.99 -17.22 28.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.145 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 9.2 mp0 -106.59 166.34 10.63 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.905 0.383 . . . . 0.0 110.872 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.02 113.97 8.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.732 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 9.1 t -59.34 136.89 58.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.943 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.493 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 13.3 t -97.97 136.23 38.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.677 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.82 89.69 4.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.938 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 30.0 p90 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.238 -0.887 . . . . 0.0 112.114 -179.603 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.603 ' O ' HG23 ' A' ' 1' ' ' ILE . 4.1 tt . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 120.919 0.39 . . . . 0.0 111.02 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 37.8 mtt -105.84 109.04 20.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.914 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -47.97 105.92 0.08 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.156 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -72.41 167.66 20.07 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.075 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 178.45 39.46 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.576 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 2.8 mmm -105.01 -152.26 0.46 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.722 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -175.71 146.19 0.74 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 120.819 0.343 . . . . 0.0 110.825 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.728 ' HB3' ' CD1' ' A' ' 10' ' ' TRP . . . -55.09 177.26 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.244 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.02 8.89 27.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.215 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.728 ' CD1' ' HB3' ' A' ' 8' ' ' ALA . 8.0 m95 -54.57 -29.84 52.49 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.816 0.341 . . . . 0.0 111.091 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.6 t -108.65 40.07 1.87 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.918 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -164.26 -51.25 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.863 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 61.64 100.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.897 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -119.6 -117.09 2.62 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.478 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.593 HG23 ' HA ' ' A' ' 42' ' ' TYR . 21.7 t -132.45 80.42 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.855 0.36 . . . . 0.0 111.15 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.3 t -72.49 89.54 1.27 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.639 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -140.49 -166.58 2.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.768 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.456 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 11.8 t70 -66.17 136.11 55.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.864 0.364 . . . . 0.0 110.695 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.8 mtmm -60.69 -29.54 69.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.736 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.6 t -107.66 35.77 2.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.605 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.456 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 0.5 OUTLIER -75.46 -164.5 0.34 Allowed 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.4 -179.982 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -118.99 18.16 13.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.695 0.283 . . . . 0.0 111.201 -179.758 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -148.18 35.7 0.82 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.876 0.37 . . . . 0.0 110.69 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -97.29 126.94 42.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.999 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.3 mtpp -113.08 163.56 17.76 Favored Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.964 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.74 91.67 0.09 OUTLIER 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.55 2.167 . . . . 0.0 112.58 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' MET . . . . . 0.465 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -77.97 171.72 14.57 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.175 0.512 . . . . 0.0 111.286 179.812 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.482 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -122.76 108.9 13.56 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.437 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.505 ' CE2' HG22 ' A' ' 30' ' ' THR . 9.3 p-90 37.49 -159.32 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.098 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.505 HG22 ' CE2' ' A' ' 29' ' ' TRP . 3.0 p 65.4 157.37 0.1 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.737 0.303 . . . . 0.0 110.592 -179.216 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 31.4 p90 -136.72 175.38 9.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.092 -179.812 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.7 t -98.38 -73.58 0.61 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.987 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -179.59 -51.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.868 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -90.0 136.7 32.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.881 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -69.74 -6.73 33.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.807 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -89.96 -19.21 24.76 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.879 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -131.22 141.53 50.05 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.892 0.377 . . . . 0.0 110.801 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.36 158.59 23.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.835 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 9.8 t -89.99 80.76 6.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.815 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.465 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.0 OUTLIER -65.3 171.23 3.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.779 179.955 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.41 ' N ' ' HB3' ' A' ' 27' ' ' MET . 7.7 tp10 -63.86 120.72 12.45 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.061 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.593 ' HA ' HG23 ' A' ' 15' ' ' VAL . 2.9 p90 . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.235 -0.888 . . . . 0.0 112.045 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 35.6 mtm . . . . . 0 CA--C 1.527 0.077 0 CA-C-O 120.806 0.336 . . . . 0.0 110.787 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 172.57 172.45 0.11 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.793 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.36 176.44 0.25 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.133 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.2 p -111.11 29.68 7.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.969 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 9.3 m0 -54.55 -31.97 57.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.18 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.0 t -97.45 -57.92 2.13 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.987 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.537 ' CB ' HG21 ' A' ' 30' ' ' THR . 21.3 t-80 -57.85 -26.8 62.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.054 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.97 163.46 0.1 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.935 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 164.88 174.46 34.63 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.556 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.431 HG23 ' HA ' ' A' ' 42' ' ' TYR . 21.5 t -91.94 105.66 16.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.854 0.359 . . . . 0.0 111.122 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.9 t -79.02 96.09 5.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.84 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.2 -164.3 1.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.888 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 77.1 m-20 -74.46 138.55 43.32 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.86 0.362 . . . . 0.0 111.214 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.405 ' HA ' ' HG2' ' A' ' 38' ' ' LYS . 0.7 OUTLIER -52.52 -29.25 24.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.2 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.0 t -103.87 33.45 3.42 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.002 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 8.6 tt0 -65.44 133.99 52.48 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 121.287 0.565 . . . . 0.0 110.641 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.65 14.73 7.89 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.404 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.18 38.5 0.72 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.001 0.429 . . . . 0.0 110.39 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.98 154.51 19.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.17 -179.48 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.441 ' CB ' ' CD ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -105.54 179.08 0.98 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.876 -179.896 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.441 ' CD ' ' CB ' ' A' ' 25' ' ' LYS . 33.1 Cg_exo -59.91 80.22 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.514 2.143 . . . . 0.0 112.402 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.404 ' CB ' ' HA ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -55.84 164.03 1.27 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.05 179.932 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -124.78 177.55 5.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.059 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 65.7 p-90 -47.55 -29.91 3.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.397 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.537 HG21 ' CB ' ' A' ' 12' ' ' HIS . 20.0 p -65.48 151.99 45.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.907 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 28.4 p90 -137.06 -179.14 5.53 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.887 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.5 t -89.92 -66.29 0.94 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.828 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 178.53 -56.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.66 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -89.98 150.16 22.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.742 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -69.15 -8.03 41.73 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.933 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -89.76 -19.79 24.32 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.003 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 58.6 mm-40 -125.76 131.6 52.48 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.774 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.405 ' HG2' ' HA ' ' A' ' 19' ' ' LYS . 5.2 ptpt -117.3 153.56 32.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.154 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.9 t -96.33 94.63 7.56 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.609 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.404 ' HA ' ' CB ' ' A' ' 27' ' ' MET . 0.8 OUTLIER -76.9 177.19 7.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.082 -179.816 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.81 115.94 11.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.886 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.431 ' HA ' HG23 ' A' ' 15' ' ' VAL . 15.6 p90 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.227 -0.892 . . . . 0.0 112.118 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 3.5 mmt . . . . . 0 N--CA 1.457 -0.088 0 CA-C-O 120.819 0.342 . . . . 0.0 110.869 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 175.99 170.72 0.39 Allowed 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.833 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.4 ' HB3' ' CD1' ' A' ' 10' ' ' TRP . . . -68.45 -172.93 0.38 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.049 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.2 p -117.1 24.85 10.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.993 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.4 ' CD1' ' HB3' ' A' ' 8' ' ' ALA . 7.8 m95 -57.36 -27.3 62.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.142 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.7 t -89.94 -32.88 16.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.969 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -80.03 -29.62 39.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.845 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.6 m 62.12 84.31 0.14 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.913 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -113.82 -145.39 9.1 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.837 -0.696 . . . . 0.0 112.477 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.494 HG23 ' HA ' ' A' ' 42' ' ' TYR . 21.4 t -131.13 102.65 6.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.822 0.344 . . . . 0.0 111.082 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.9 t -79.81 103.27 9.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.952 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.12 -165.48 1.37 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.66 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.479 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 9.0 t70 -71.27 136.53 47.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.962 0.411 . . . . 0.0 110.972 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.423 ' HA ' ' HG2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -49.97 -36.35 27.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.027 0.441 . . . . 0.0 111.049 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.6 t -101.43 31.85 3.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.966 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.479 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 7.6 tp10 -61.94 129.95 43.33 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.214 0.531 . . . . 0.0 110.447 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.6 16.2 4.07 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.632 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -150.18 40.19 0.78 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.99 0.424 . . . . 0.0 110.374 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.85 147.79 23.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.215 -179.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.466 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 0.1 OUTLIER -98.2 172.08 5.2 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.638 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.466 ' HD2' ' HB3' ' A' ' 25' ' ' LYS . 45.3 Cg_exo -57.11 83.38 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.447 2.098 . . . . 0.0 112.541 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.553 ' HE2' ' HD3' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -54.67 168.19 0.3 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.253 179.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -120.26 173.17 7.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.867 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.634 ' CH2' HG22 ' A' ' 30' ' ' THR . 46.6 p-90 -47.07 -29.02 1.93 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.408 -179.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.634 HG22 ' CH2' ' A' ' 29' ' ' TRP . 44.3 p -65.33 165.1 12.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.087 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -135.39 -179.41 5.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.842 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 49.0 t -93.39 -78.65 0.42 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.007 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -179.49 -51.44 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.01 -179.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -89.87 144.27 26.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.888 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -66.75 -12.06 57.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.686 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -90.07 -22.63 21.72 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.126 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 -128.06 138.55 52.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.79 0.329 . . . . 0.0 111.059 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.553 ' HD3' ' HE2' ' A' ' 27' ' ' MET . 0.0 OUTLIER -123.28 158.36 31.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.043 -179.903 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 33.9 t -90.52 113.67 25.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.957 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -98.51 179.45 4.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.788 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.408 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -63.9 127.26 30.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.786 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.494 ' HA ' HG23 ' A' ' 15' ' ' VAL . 29.0 p90 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.232 -0.889 . . . . 0.0 112.17 -179.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 8.8 mmm . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.793 0.33 . . . . 0.0 110.894 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 168.42 155.03 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.795 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.81 166.67 2.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.021 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 29.3 p -105.09 20.06 19.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.25 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -57.52 -27.99 63.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.762 0.315 . . . . 0.0 111.092 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.9 t -90.09 -64.6 1.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.951 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.5 -23.93 59.22 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.154 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 66.21 147.85 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.931 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -171.35 -164.68 27.43 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.526 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.5 t -115.96 95.97 4.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.814 0.34 . . . . 0.0 111.148 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.4 t -72.02 95.84 1.65 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.778 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.4 -168.04 1.99 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.774 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -74.9 136.78 41.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.8 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.7 mttm -53.83 -28.06 33.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.918 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 29.3 t -105.31 34.53 3.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.739 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -73.22 149.29 42.95 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.297 0.57 . . . . 0.0 110.616 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -98.65 17.57 18.89 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.127 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -148.01 28.93 0.91 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.833 0.349 . . . . 0.0 110.682 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.35 147.47 23.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.995 -179.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.443 ' HB3' ' HB3' ' A' ' 41' ' ' GLU . 1.1 mptp? -101.07 177.54 1.49 Allowed Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.747 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.411 ' CD ' ' CB ' ' A' ' 25' ' ' LYS . 47.5 Cg_exo -56.67 82.86 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.434 2.089 . . . . 0.0 112.525 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.406 ' N ' ' O ' ' A' ' 25' ' ' LYS . 5.5 ppp? -52.82 164.42 0.38 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.299 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -124.49 174.53 7.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.051 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.471 ' CH2' HG22 ' A' ' 30' ' ' THR . 55.2 p-90 -49.16 -30.66 7.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.287 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.471 HG22 ' CH2' ' A' ' 29' ' ' TRP . 13.2 p -58.66 158.24 8.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.899 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -129.46 172.38 11.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.859 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 40.8 t -90.03 -73.78 0.51 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.937 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -179.13 -49.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.736 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -89.97 140.91 29.17 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.787 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -70.53 -6.98 40.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.946 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -89.91 -14.03 35.05 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.17 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.41 161.59 35.03 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.801 0.334 . . . . 0.0 110.787 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -130.54 162.53 29.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.113 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.6 t -99.91 104.77 16.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.86 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 m -81.31 176.87 9.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.737 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.443 ' HB3' ' HB3' ' A' ' 25' ' ' LYS . 0.3 OUTLIER -71.05 116.62 11.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.717 179.908 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 1.8 p90 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.245 -0.884 . . . . 0.0 112.198 -179.512 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 72.3 mtp . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.81 0.338 . . . . 0.0 111.16 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.451 ' N ' ' CE2' ' A' ' 31' ' ' TYR . 0.0 OUTLIER 174.58 157.62 0.16 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.723 179.728 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.79 156.81 10.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.235 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.6 p -115.1 25.8 10.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.966 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 11.8 m0 -55.45 -38.44 69.05 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.131 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -108.26 30.35 6.49 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.046 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -147.36 21.21 1.2 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.146 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 53.25 178.84 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.781 0.324 . . . . 0.0 111.025 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 145.42 171.79 15.32 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.615 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.4 t -120.19 85.12 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.837 0.351 . . . . 0.0 111.074 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.7 t -61.69 94.78 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.976 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.58 -163.63 0.92 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.624 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -88.59 137.73 32.06 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.738 0.304 . . . . 0.0 110.897 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.1 mtpp -50.86 -30.77 15.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.913 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.9 t -99.23 25.12 7.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.851 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -60.51 118.26 6.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.087 0.47 . . . . 0.0 110.565 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.29 12.31 18.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.558 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -150.08 40.13 0.78 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.169 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -98.84 179.17 4.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.609 -179.181 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.7 mmtt -115.18 164.69 16.13 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.289 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -50.52 90.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.483 2.122 . . . . 0.0 112.651 -179.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.42 ' CB ' ' HA ' ' A' ' 40' ' ' CYS . 0.1 OUTLIER -60.15 168.54 1.91 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.98 179.727 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -122.26 174.3 7.07 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.931 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.763 ' CH2' HG22 ' A' ' 30' ' ' THR . 37.5 p-90 -49.38 -26.76 3.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.451 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.763 HG22 ' CH2' ' A' ' 29' ' ' TRP . 15.7 p -66.94 157.92 32.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.85 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.451 ' CE2' ' N ' ' A' ' 7' ' ' GLN . 15.1 p90 -137.37 177.51 7.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.967 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 4.1 t -89.92 -67.37 0.85 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.986 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -179.45 -53.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.701 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 55.3 t30 -90.0 152.44 21.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.751 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -66.79 -11.55 55.52 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.824 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -90.01 -22.64 21.78 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.082 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -114.87 134.35 55.21 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.753 0.311 . . . . 0.0 110.992 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.415 ' NZ ' ' HG2' ' A' ' 27' ' ' MET . 0.0 OUTLIER -122.63 154.82 37.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.121 179.976 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 9.0 t -87.5 99.28 11.91 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.589 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.42 ' HA ' ' CB ' ' A' ' 27' ' ' MET . 0.7 OUTLIER -79.83 174.84 11.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.302 -179.548 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -58.13 106.77 0.4 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.005 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 10.5 p90 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.235 -0.888 . . . . 0.0 112.053 -179.584 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 30.6 mmm . . . . . 0 CA--C 1.527 0.065 0 CA-C-O 120.768 0.318 . . . . 0.0 110.752 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 169.94 179.82 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.817 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.515 ' HB3' ' NE1' ' A' ' 10' ' ' TRP . . . -100.51 -177.21 3.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.133 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 27.3 p -109.89 27.77 9.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.0 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.515 ' NE1' ' HB3' ' A' ' 8' ' ' ALA . 9.7 m95 -54.49 -31.25 55.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.033 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.4 t -97.3 -52.2 3.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.849 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -59.62 -25.95 65.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.945 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.5 p 63.32 143.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.974 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -165.87 -134.48 1.68 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.5 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.436 ' CG2' ' HA ' ' A' ' 42' ' ' TYR . 21.8 t -141.06 82.02 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.859 0.362 . . . . 0.0 111.068 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.0 t -66.37 89.32 0.14 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.808 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.18 -166.26 1.2 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.738 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.66 136.23 41.92 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.825 0.345 . . . . 0.0 110.91 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.4 mttt -63.53 -34.95 78.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.653 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.1 t -104.79 34.76 3.02 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.41 179.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.85 -175.63 3.55 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.351 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -123.04 17.96 10.04 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.496 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.02 40.0 0.78 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.88 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -97.14 146.97 24.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.039 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.491 ' CB ' ' HD2' ' A' ' 26' ' ' PRO . 1.0 OUTLIER -106.15 170.83 5.37 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.763 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.491 ' HD2' ' CB ' ' A' ' 25' ' ' LYS . 9.5 Cg_endo -52.49 87.72 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.393 2.062 . . . . 0.0 112.246 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.402 ' N ' ' O ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -62.46 165.77 5.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.137 -179.902 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -115.13 177.69 4.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.012 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 64.1 p-90 -49.97 -36.18 27.19 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.292 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 19.1 p -58.92 148.78 29.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.967 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 16.8 p90 -130.68 179.96 5.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.917 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.5 t -94.43 -69.5 0.75 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.892 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.4 pp20? 178.54 -46.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.862 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -96.66 146.87 24.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.862 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -69.14 -8.3 44.24 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.871 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -89.8 -19.28 24.88 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.059 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -129.39 141.12 51.14 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.812 0.339 . . . . 0.0 110.853 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -131.78 158.06 42.22 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.095 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 17.8 t -86.26 93.15 8.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.591 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -82.07 166.41 19.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.975 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.88 139.23 52.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.935 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.436 ' HA ' ' CG2' ' A' ' 15' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.237 -0.887 . . . . 0.0 112.277 -179.587 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 8.3 mtt . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.747 0.308 . . . . 0.0 110.88 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 178.05 -172.45 0.12 Allowed 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.924 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.59 157.29 35.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.254 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.5 p -107.89 25.45 11.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.97 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 18.1 m0 -55.99 -32.1 63.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.256 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.0 t -89.98 -34.3 16.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.962 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -70.0 -16.42 63.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.276 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 67.34 126.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.859 0.361 . . . . 0.0 110.929 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -172.87 -167.8 33.3 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.825 -0.703 . . . . 0.0 112.288 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.424 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 24.4 t -122.84 95.16 3.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.967 0.413 . . . . 0.0 111.166 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.7 t -62.51 86.25 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.894 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.38 -163.21 1.02 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.765 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -96.07 142.01 28.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.842 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.16 -40.69 90.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.894 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.7 t -73.42 -11.89 60.62 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.136 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -102.62 95.14 6.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.829 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.43 ' CD ' ' N ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -97.67 40.29 1.17 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.967 -179.794 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -98.35 24.76 6.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.96 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -121.69 -173.73 2.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.683 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.26 155.4 84.14 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.645 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -64.16 103.33 0.42 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.418 2.079 . . . . 0.0 112.328 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 12.6 ptm -60.81 163.62 5.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.129 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.437 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -134.41 104.76 6.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.824 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.437 ' CD1' ' O ' ' A' ' 28' ' ' ALA . 0.5 OUTLIER 47.75 -178.71 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.418 -179.815 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 63.37 161.72 0.1 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.633 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -139.32 -178.86 5.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.945 0.402 . . . . 0.0 111.229 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 36.1 t -89.84 -64.03 1.2 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.762 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -178.47 -44.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.679 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 60.5 t30 -107.89 150.49 26.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.663 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -69.85 -7.0 36.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.926 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -89.74 -17.83 27.51 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.965 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -119.13 149.34 41.87 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.817 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -121.52 162.43 20.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.952 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 15.4 t -95.82 83.21 3.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.825 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.424 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -55.7 154.04 7.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.668 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.65 107.99 5.43 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.059 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 28.4 p90 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.079 -179.6 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 40.2 mtt . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.72 0.295 . . . . 0.0 110.869 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 175.53 160.41 0.25 Allowed 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.918 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.37 153.66 40.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.184 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.5 p -113.81 19.6 16.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.18 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 50.3 m0 -56.51 -44.74 81.04 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.831 0.348 . . . . 0.0 111.082 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.85 -20.21 23.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.239 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 13.0 m-70 -96.18 24.28 5.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.069 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.0 t 56.95 179.95 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.989 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 139.24 166.0 10.45 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.476 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.486 HG23 ' HA ' ' A' ' 42' ' ' TYR . 21.2 t -116.1 87.86 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.868 0.366 . . . . 0.0 111.17 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 49.5 t -67.05 99.69 0.68 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.939 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.51 -164.65 1.12 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.603 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -83.1 138.3 33.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.824 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.1 mttm -49.76 -29.81 8.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.949 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.8 t -103.4 28.17 6.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.711 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 -60.63 117.52 5.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.715 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.76 12.92 13.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.446 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -149.29 42.67 0.93 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.204 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -104.21 173.18 6.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.479 -179.112 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -104.34 168.13 8.98 Favored Pre-proline 0 C--N 1.332 -0.189 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.546 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.78 93.57 0.32 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.48 2.12 . . . . 0.0 112.545 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.482 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 3.5 ptm -59.24 168.77 1.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.38 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.49 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -147.95 109.42 4.37 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.02 179.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.983 ' CE2' HG23 ' A' ' 30' ' ' THR . 2.8 p-90 38.58 -159.1 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.277 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.983 HG23 ' CE2' ' A' ' 29' ' ' TRP . 2.1 p 51.73 -179.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.864 0.364 . . . . 0.0 111.294 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.2 p90 -154.69 179.59 8.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.733 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 41.1 t -90.29 -72.72 0.55 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.797 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -178.61 -39.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.711 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -107.5 147.91 29.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.775 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.3 mmp_? -67.98 -8.79 40.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.983 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -89.82 -22.2 22.21 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.003 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -123.45 144.04 49.76 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.803 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -122.09 157.11 32.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.185 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 16.9 t -85.53 117.41 24.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.547 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.482 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.6 OUTLIER -96.57 176.6 5.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.328 -179.544 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.93 105.2 2.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.965 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.486 ' HA ' HG23 ' A' ' 15' ' ' VAL . 1.7 p90 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.224 -0.893 . . . . 0.0 112.084 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . 0.441 ' HB3' ' CD2' ' A' ' 31' ' ' TYR . 6.0 mmt . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.878 0.37 . . . . 0.0 110.974 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.759 ' O ' HG22 ' A' ' 30' ' ' THR . 6.3 tp60 177.76 159.63 0.47 Allowed 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.771 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.6 147.33 32.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.048 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 15.1 p -95.08 18.61 11.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.216 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 20.4 m0 -57.33 -42.93 82.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.818 0.342 . . . . 0.0 111.013 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.38 -20.36 22.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.278 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -95.39 23.26 6.07 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.267 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.6 m 57.78 -168.46 0.12 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.033 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.402 ' N ' ' HB3' ' A' ' 42' ' ' TYR . . . 116.72 156.84 10.74 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.304 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.476 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 34.4 t -112.64 85.93 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.965 0.412 . . . . 0.0 111.07 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 46.4 t -57.56 100.64 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.178 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -119.27 -159.72 0.78 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.468 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -84.88 144.27 28.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.912 0.386 . . . . 0.0 110.967 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.6 mmtm -49.09 -27.35 3.31 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.244 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.41 ' O ' ' CD ' ' A' ' 22' ' ' ARG . 12.4 t -94.1 29.77 2.06 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.743 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.58 114.28 2.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.987 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.41 ' CD ' ' O ' ' A' ' 20' ' ' SER . 0.0 OUTLIER -115.64 19.15 15.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.194 179.839 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -123.38 -32.12 3.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.705 0.288 . . . . 0.0 111.392 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.7 -171.3 3.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.828 0.347 . . . . 0.0 110.893 -179.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.3 mtpt -98.33 167.69 11.12 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.93 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -66.9 123.16 10.64 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.535 2.156 . . . . 0.0 112.311 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.5 153.66 15.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.002 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -130.94 102.23 5.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.919 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.412 ' CD1' ' OG1' ' A' ' 30' ' ' THR . 0.0 OUTLIER 54.28 173.29 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.814 -179.858 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.759 HG22 ' O ' ' A' ' 7' ' ' GLN . 0.2 OUTLIER 67.02 162.9 0.18 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.549 -179.459 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.441 ' CD2' ' HB3' ' A' ' 6' ' ' MET . 8.0 p90 -135.56 169.63 17.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.965 0.412 . . . . 0.0 110.948 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 41.1 t -89.92 -64.14 1.18 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.782 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -178.38 -49.16 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.643 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -106.75 148.61 28.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.684 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -69.25 -7.34 35.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.927 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -89.95 -19.31 24.65 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.112 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 9.5 mp0 -109.8 148.24 31.83 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.833 0.349 . . . . 0.0 111.03 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.5 132.4 53.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.857 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.6 t -77.87 97.3 5.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.992 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.476 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -57.47 154.26 11.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.761 179.85 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -57.96 110.0 0.84 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.995 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.402 ' HB3' ' N ' ' A' ' 14' ' ' GLY . 13.9 p90 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.231 -0.89 . . . . 0.0 112.045 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 3.9 mtp . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.926 0.393 . . . . 0.0 110.994 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 65.61 -176.16 0.18 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.837 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.44 ' HB3' ' CD1' ' A' ' 10' ' ' TRP . . . -96.71 -179.55 4.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.202 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.5 p -114.47 26.24 10.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.942 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.44 ' CD1' ' HB3' ' A' ' 8' ' ' ALA . 14.8 m95 -55.91 -47.63 77.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.078 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 47.4 t -98.23 30.96 2.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.94 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -145.49 29.43 1.14 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.806 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.8 m 58.35 -176.12 0.08 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.933 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 110.97 156.5 14.36 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.485 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.491 HG22 ' CE1' ' A' ' 42' ' ' TYR . 15.9 t -122.07 114.84 44.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.868 0.366 . . . . 0.0 111.135 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 37.5 t -70.08 87.03 0.56 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.954 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.75 -161.84 0.77 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.538 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -83.71 140.59 32.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.835 0.35 . . . . 0.0 110.827 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.47 -33.64 14.81 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.109 0.48 . . . . 0.0 111.075 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.6 t -100.33 27.0 6.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.943 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.417 ' CG ' ' HB2' ' A' ' 24' ' ' CYS . 4.2 tp10 -57.37 113.75 1.9 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.987 0.422 . . . . 0.0 110.671 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.62 23.83 7.37 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.403 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -138.73 8.37 2.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.603 -0.272 . . . . 0.0 111.706 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.417 ' HB2' ' CG ' ' A' ' 21' ' ' GLU . 0.5 OUTLIER -131.53 167.11 19.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.587 0.232 . . . . 0.0 110.809 -179.695 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 18.0 mmtt -81.13 161.1 63.99 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 120.778 0.323 . . . . 0.0 110.96 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -57.86 124.26 15.58 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.624 2.216 . . . . 0.0 112.436 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -57.68 164.14 2.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.228 -179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.457 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -125.37 98.58 5.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.636 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.505 ' CE2' ' CG2' ' A' ' 30' ' ' THR . 7.0 p-90 36.87 -159.7 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.068 -0.514 . . . . 0.0 112.035 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.505 ' CG2' ' CE2' ' A' ' 29' ' ' TRP . 2.5 p 61.82 174.79 0.12 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.687 0.28 . . . . 0.0 110.406 -179.007 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 5.9 p90 -141.56 152.49 44.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.949 0.404 . . . . 0.0 111.122 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.3 t -89.85 -56.09 3.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.777 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -176.23 -46.38 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.563 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -109.4 151.53 26.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.639 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -67.58 -10.17 49.52 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 120.861 0.362 . . . . 0.0 111.789 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -91.17 -21.45 21.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.072 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -89.56 146.72 24.39 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.778 0.323 . . . . 0.0 111.069 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 8.0 ptpt -125.42 149.44 48.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.997 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 41.8 t -91.78 76.07 5.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.8 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 12.7 t -43.9 157.65 0.05 Allowed 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.388 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -95.46 102.09 13.86 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.822 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.491 ' CE1' HG22 ' A' ' 15' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.227 -0.892 . . . . 0.0 112.297 -179.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . 0.417 ' O ' ' HB2' ' A' ' 7' ' ' GLN . 35.4 mtp . . . . . 0 C--O 1.23 0.065 0 CA-C-O 120.754 0.312 . . . . 0.0 110.903 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 6' ' ' MET . 15.9 tt0 177.36 155.93 0.31 Allowed 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.788 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.46 161.34 9.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.179 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 3.8 p -120.16 10.27 11.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.213 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 16.9 m0 -54.59 -47.49 73.27 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.894 0.378 . . . . 0.0 111.103 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.68 31.12 6.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.837 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -138.29 38.9 2.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.906 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 52.0 m 61.95 115.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.936 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 156.97 149.17 5.32 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.531 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.8 t -126.58 94.86 2.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.893 0.378 . . . . 0.0 111.186 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 51.0 t -58.32 105.69 0.31 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.019 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.96 -166.54 1.18 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.809 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -89.07 133.48 34.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.887 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.34 -30.35 68.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.002 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 46.5 t -91.75 16.96 9.67 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.345 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -100.55 -42.51 6.53 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.732 0.301 . . . . 0.0 110.95 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 40.49 41.09 1.0 Allowed 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.869 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -110.94 13.57 22.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.13 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.4 t -132.43 178.64 6.67 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.788 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.403 ' CB ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -67.16 168.44 11.28 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.781 179.935 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.403 ' HD2' ' CB ' ' A' ' 25' ' ' LYS . 51.0 Cg_endo -69.4 119.31 6.29 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.531 2.154 . . . . 0.0 112.505 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.405 ' HG2' ' N ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -50.21 142.53 9.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.173 179.895 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.469 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -117.54 102.72 9.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.691 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.553 ' CE2' HG22 ' A' ' 30' ' ' THR . 5.9 p-90 36.79 -158.15 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.965 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.553 HG22 ' CE2' ' A' ' 29' ' ' TRP . 3.0 p 64.76 176.86 0.19 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.74 0.305 . . . . 0.0 110.59 -179.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.416 ' CE2' ' N ' ' A' ' 7' ' ' GLN . 6.7 p90 -140.39 153.13 46.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.07 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 38.0 t -97.84 -72.01 0.66 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.726 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -176.83 -48.82 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.751 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -103.19 138.13 40.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.752 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.4 mmp_? -68.52 -6.99 28.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.792 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -98.18 12.92 33.01 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.186 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 63.2 mm-40 -126.87 162.12 26.67 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.866 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -133.22 129.2 37.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.961 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.7 t -76.91 89.89 3.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.038 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.4 t -46.2 156.0 0.18 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.12 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -123.66 56.32 1.22 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.931 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 2.3 p90 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.22 -0.895 . . . . 0.0 112.095 -179.505 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.1 mtp . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.743 0.306 . . . . 0.0 111.015 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.477 ' O ' HG22 ' A' ' 30' ' ' THR . 4.8 mt-30 166.8 170.58 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.726 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.454 ' CB ' ' CD1' ' A' ' 10' ' ' TRP . . . -59.69 151.35 25.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.061 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 27.6 p -96.96 23.95 6.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.259 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.454 ' CD1' ' CB ' ' A' ' 8' ' ' ALA . 15.8 m95 -55.89 -36.22 67.41 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.865 0.364 . . . . 0.0 110.971 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 t -89.99 -44.33 9.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.793 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.62 -27.77 69.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.89 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.1 p 63.8 137.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.017 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -169.47 -159.24 14.73 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.271 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.428 ' O ' ' HB2' ' A' ' 40' ' ' CYS . 25.1 t -128.23 83.87 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.951 0.405 . . . . 0.0 111.212 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.4 t -58.8 95.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.934 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.02 -161.89 0.99 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.812 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.403 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 0.2 OUTLIER -83.74 137.64 33.65 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.889 0.375 . . . . 0.0 110.832 179.992 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -50.71 -27.33 6.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.057 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.1 t -99.56 27.06 5.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.1 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.423 ' HB3' ' HB2' ' A' ' 24' ' ' CYS . 21.7 tp10 -60.4 118.5 6.54 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 121.012 0.434 . . . . 0.0 110.383 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.61 13.1 14.87 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.79 -179.154 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -150.26 43.96 0.87 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.904 0.383 . . . . 0.0 110.519 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.423 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 0.1 OUTLIER -116.63 -178.58 3.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.587 -178.983 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.72 166.7 15.68 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.602 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.02 109.23 2.84 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.58 2.187 . . . . 0.0 112.714 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.468 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -75.3 171.81 13.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.329 179.825 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.487 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -127.47 110.02 12.34 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.496 179.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.689 ' CZ2' HG23 ' A' ' 30' ' ' THR . 2.2 p-90 41.91 -167.43 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.869 -179.587 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.689 HG23 ' CZ2' ' A' ' 29' ' ' TRP . 0.2 OUTLIER 56.61 167.44 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.749 -179.231 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 46.7 p90 -140.24 179.17 6.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.926 0.394 . . . . 0.0 111.201 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 30.9 t -89.94 -71.45 0.61 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.691 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -179.47 -56.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.68 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 31.4 t-20 -90.27 141.82 28.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.658 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.3 mmp_? -68.16 -7.3 28.86 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.277 -0.419 . . . . 0.0 112.022 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -89.71 -22.74 22.07 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.801 179.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -124.7 139.15 54.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.685 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.67 143.7 45.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.054 -179.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 8.2 t -75.9 105.0 6.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.611 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.468 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.3 OUTLIER -72.76 177.74 4.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.23 -179.817 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.94 118.8 22.02 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.913 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 27.5 p90 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.239 -0.886 . . . . 0.0 112.129 -179.559 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 6.8 mtt . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.746 0.308 . . . . 0.0 110.945 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 167.92 158.26 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.732 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.56 166.65 5.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.103 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 31.8 p -103.55 18.27 22.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.244 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 8.7 m95 -57.41 -31.99 66.41 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.865 0.364 . . . . 0.0 111.135 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 t -89.86 -42.2 11.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.872 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -68.43 -25.33 64.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.945 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.6 t 64.47 118.21 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.926 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -153.23 -157.57 8.12 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.456 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 31.1 t -128.15 94.07 2.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.809 0.338 . . . . 0.0 111.072 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.1 t -72.86 96.7 2.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.723 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.61 -162.21 0.86 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.666 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -77.72 137.1 38.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.762 0.315 . . . . 0.0 110.811 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -48.43 -28.4 3.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.143 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.5 t -96.89 29.89 2.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.802 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.407 ' HG3' ' N ' ' A' ' 24' ' ' CYS . 6.3 tp10 -57.9 118.76 5.69 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.735 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -83.28 7.48 16.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.786 -179.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -146.54 40.69 1.11 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.962 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.407 ' N ' ' HG3' ' A' ' 21' ' ' GLU . 0.1 OUTLIER -91.25 154.22 19.43 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.554 -178.955 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.8 mttt -107.85 158.79 32.57 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.774 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -67.78 90.86 0.36 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.546 2.164 . . . . 0.0 112.631 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.452 ' HB2' ' HA ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -70.3 168.8 15.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.286 179.757 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.483 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -118.15 106.12 12.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.138 179.451 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.503 ' CE2' HG22 ' A' ' 30' ' ' THR . 10.0 p-90 38.4 -160.11 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.907 -179.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.503 HG22 ' CE2' ' A' ' 29' ' ' TRP . 2.7 p 64.89 169.12 0.19 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.737 0.303 . . . . 0.0 110.555 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 38.1 p90 -141.81 174.66 10.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.026 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 35.4 t -89.9 -78.03 0.38 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.833 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 179.92 -54.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.707 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -89.9 139.66 30.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.786 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -67.96 -8.09 34.18 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.806 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 44.0 t-20 -89.98 -22.83 21.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.925 179.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 13.4 mp0 -127.69 147.23 50.38 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.775 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.14 149.06 50.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.177 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.5 t -80.06 127.4 32.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.681 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.452 ' HA ' ' HB2' ' A' ' 27' ' ' MET . 0.1 OUTLIER -112.27 169.55 8.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.192 -179.727 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -57.67 129.24 40.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.053 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 21.0 p90 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.208 -0.901 . . . . 0.0 112.073 -179.583 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 12.9 mtt . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.764 0.316 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 168.88 -172.99 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.9 179.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.407 ' CB ' ' NE1' ' A' ' 10' ' ' TRP . . . -95.52 162.74 13.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.157 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.2 p -105.74 25.0 11.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.163 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.407 ' NE1' ' CB ' ' A' ' 8' ' ' ALA . 11.1 m95 -55.77 -39.2 70.89 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.879 0.371 . . . . 0.0 111.08 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.5 t -119.12 35.13 4.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.889 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -133.91 28.58 3.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.975 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.1 m 57.79 -175.48 0.07 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.997 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.01 163.45 24.86 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.462 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.413 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 3.1 t -118.2 96.91 4.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.907 0.385 . . . . 0.0 111.109 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 39.9 t -69.78 91.31 0.63 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.886 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.49 -167.04 1.33 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.507 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -111.13 74.75 0.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.868 0.366 . . . . 0.0 110.486 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.8 35.27 11.28 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.182 0.515 . . . . 0.0 109.97 -179.351 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.4 t -88.7 25.49 1.73 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.995 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -67.19 -1.95 5.1 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.625 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.97 10.45 11.78 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-O 120.787 0.327 . . . . 0.0 111.637 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.13 -23.96 0.25 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.309 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.01 -178.02 4.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.807 0.337 . . . . 0.0 111.032 -179.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.1 mmmt -87.28 164.07 37.16 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.848 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -60.35 119.67 6.99 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.657 2.238 . . . . 0.0 112.454 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 6.8 ptt? -55.59 169.47 0.32 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.022 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -103.87 179.0 4.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.73 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.74 ' CE2' HG23 ' A' ' 30' ' ' THR . 45.9 p-90 -49.24 -44.67 43.77 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.315 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.74 HG23 ' CE2' ' A' ' 29' ' ' TRP . 74.5 p -58.88 156.43 11.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 9.7 p90 -133.14 -179.23 5.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.926 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.04 -71.73 0.67 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.995 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -178.49 -48.89 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.765 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -89.9 139.55 30.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.918 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -66.13 -11.23 47.81 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.73 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -91.98 -24.03 19.36 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.043 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -97.72 135.69 39.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.833 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.64 143.37 47.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.041 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.3 t -91.31 89.02 7.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.967 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.413 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 2.8 t -50.44 153.86 1.45 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.04 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -102.68 95.2 6.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.828 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 6.2 p90 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.221 -0.895 . . . . 0.0 112.226 -179.564 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 37.8 mmm . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.809 0.338 . . . . 0.0 111.008 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.428 ' O ' HG22 ' A' ' 30' ' ' THR . 1.4 mt-30 169.33 -169.98 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.747 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.41 156.14 37.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.107 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.5 p -95.55 22.73 6.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.106 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 15.5 m0 -59.39 -25.46 64.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.302 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.4 t -89.96 -33.53 16.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.995 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -83.76 -25.12 30.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.051 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.4 m 65.82 122.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.945 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -154.22 -161.37 10.41 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.339 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.41 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 29.2 t -116.14 87.09 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.884 0.373 . . . . 0.0 111.103 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.6 t -57.22 91.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.108 -179.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.6 ttt85 -107.27 -158.64 0.66 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.565 179.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -93.02 146.79 23.37 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.825 0.345 . . . . 0.0 110.977 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.37 -26.81 8.41 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.03 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.442 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 33.3 t -97.95 32.72 2.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.459 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -61.45 117.07 5.22 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.178 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.442 ' HG3' ' O ' ' A' ' 20' ' ' SER . 0.0 OUTLIER -119.41 16.61 13.01 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.346 179.757 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -125.64 -26.51 3.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.662 0.268 . . . . 0.0 111.568 -179.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.71 -176.43 4.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.954 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.49 161.79 38.55 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.94 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -64.42 115.22 3.06 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.502 2.135 . . . . 0.0 112.18 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.79 156.22 11.57 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.067 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.473 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -127.89 105.26 8.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.511 179.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.514 ' CH2' HG23 ' A' ' 30' ' ' THR . 1.1 p-90 48.32 -179.74 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.344 -179.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.514 HG23 ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER 59.74 167.72 0.07 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.615 -179.308 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 5.6 p90 -144.09 178.31 7.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.146 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 38.6 t -89.89 -65.82 0.98 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.814 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -174.12 -55.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.713 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -91.44 149.87 21.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.694 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -68.6 -9.61 50.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.752 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -91.67 -18.89 23.3 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.223 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -106.26 150.99 25.38 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.853 0.359 . . . . 0.0 111.012 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -131.77 137.3 48.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.901 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.3 t -76.63 92.19 3.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.07 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.41 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 0.0 OUTLIER -58.72 156.55 10.84 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.571 179.831 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -58.06 124.04 17.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.029 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 15.3 p90 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.228 -0.891 . . . . 0.0 112.106 -179.638 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 49.7 mtp . . . . . 0 N--CA 1.457 -0.109 0 CA-C-O 120.854 0.359 . . . . 0.0 111.015 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 175.24 -167.61 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.661 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -112.23 176.23 5.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.215 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.5 p -114.43 28.81 8.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.075 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 8.3 m0 -52.67 -28.49 21.88 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.076 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 40.6 t -138.0 34.54 2.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.839 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -120.82 15.61 11.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.263 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 62.52 124.59 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.856 0.36 . . . . 0.0 111.058 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 162.11 164.83 17.9 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.474 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.456 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 1.5 t -112.96 106.04 19.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.854 0.359 . . . . 0.0 111.243 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 46.2 t -81.45 101.08 9.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.944 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.2 ttt85 -144.44 -161.59 1.31 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.756 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.419 ' CB ' ' HB3' ' A' ' 21' ' ' GLU . 1.5 m-20 -70.65 139.87 51.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.907 0.384 . . . . 0.0 110.87 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.472 ' CE ' ' HE2' ' A' ' 27' ' ' MET . 25.4 mtpt -79.33 -55.23 5.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.895 -179.368 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.7 t -82.3 7.97 12.5 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.936 -179.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.419 ' HB3' ' CB ' ' A' ' 18' ' ' ASP . 0.8 OUTLIER -107.67 -72.74 0.71 Allowed 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 120.722 0.296 . . . . 0.0 111.541 -179.575 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.22 156.75 33.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.046 0.451 . . . . 0.0 111.8 -179.341 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -115.82 56.49 0.77 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.155 179.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.72 -175.11 4.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.016 -179.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.56 167.75 5.15 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.595 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -76.24 105.74 2.13 Favored 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.415 2.077 . . . . 0.0 112.554 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.472 ' HE2' ' CE ' ' A' ' 19' ' ' LYS . 14.5 ptt? -45.75 167.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.056 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -117.1 -177.54 3.23 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.024 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 56.0 p-90 -43.2 -39.24 2.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.354 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 32.4 p -60.18 146.74 42.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.589 179.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -137.71 177.96 7.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.926 0.393 . . . . 0.0 111.233 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.19 -70.47 0.7 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.794 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -170.74 -39.16 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.626 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -108.38 144.52 35.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.528 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -69.13 -7.75 39.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.303 -0.408 . . . . 0.0 112.002 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -89.84 2.84 54.47 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.38 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -127.23 141.4 51.74 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.742 0.306 . . . . 0.0 110.894 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.454 ' HG2' ' HA ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -116.13 155.36 28.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.079 -179.843 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 11.9 t -104.28 85.0 2.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.389 179.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.456 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 5.0 t -42.81 136.27 2.68 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.215 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -86.65 112.73 21.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.897 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.174 -0.917 . . . . 0.0 112.358 -179.535 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 7.6 mtt . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.786 0.327 . . . . 0.0 110.894 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 173.38 169.83 0.16 Allowed 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.831 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.532 ' HB1' ' CE2' ' A' ' 10' ' ' TRP . . . -72.92 164.53 26.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.141 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 26.5 p -109.5 22.21 16.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.131 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.532 ' CE2' ' HB1' ' A' ' 8' ' ' ALA . 6.3 m95 -57.31 -51.23 70.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.963 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 21.7 t -89.93 7.89 35.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.333 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -111.54 -22.48 11.23 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.754 0.312 . . . . 0.0 111.161 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 66.65 146.37 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.952 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -179.91 -149.62 8.64 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.421 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.736 HG23 ' HA ' ' A' ' 42' ' ' TYR . 21.7 t -142.73 87.66 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.804 0.335 . . . . 0.0 111.0 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 48.0 t -66.42 94.35 0.27 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.652 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.04 -171.5 2.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.674 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.455 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 2.2 m-20 -72.81 135.45 45.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.848 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.402 ' HG2' ' HG2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -59.08 -37.27 76.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.953 179.994 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.1 t -101.95 33.12 3.15 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.893 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.455 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 0.9 OUTLIER -75.06 -174.51 2.29 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.095 179.768 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -123.38 17.4 9.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.507 -179.478 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.08 37.34 0.7 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.833 0.349 . . . . 0.0 110.819 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -95.47 133.18 39.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.087 -179.655 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.5 mmtp -93.32 158.64 36.74 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.854 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -48.04 90.89 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.681 2.254 . . . . 0.0 112.337 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.422 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 2.0 ppp? -54.67 165.4 0.6 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.432 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.465 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -134.81 93.45 3.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.652 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.526 ' CE2' HG22 ' A' ' 30' ' ' THR . 9.5 p-90 37.29 -158.96 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.889 -179.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.526 HG22 ' CE2' ' A' ' 29' ' ' TRP . 1.7 p 62.78 -177.02 0.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.793 0.33 . . . . 0.0 110.607 -179.104 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -152.65 160.62 43.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.916 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 41.0 t -89.99 -71.74 0.6 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.815 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -165.42 -68.98 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.899 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -90.04 153.61 20.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.82 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -68.41 -8.57 41.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.991 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -89.87 -20.92 22.84 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.053 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -122.81 128.55 50.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.809 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.402 ' HG2' ' HG2' ' A' ' 19' ' ' LYS . 0.1 OUTLIER -117.24 150.96 37.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.146 -179.82 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.2 t -80.85 83.33 6.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.552 179.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.422 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.2 OUTLIER -66.55 176.83 1.75 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.089 -179.696 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -63.72 118.87 8.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.015 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.736 ' HA ' HG23 ' A' ' 15' ' ' VAL . 2.8 p90 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.229 -0.891 . . . . 0.0 112.062 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.6 mtp . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.801 0.334 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 177.72 175.8 0.45 Allowed 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.938 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.56 ' HB3' ' CE3' ' A' ' 10' ' ' TRP . . . -81.77 172.58 13.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.267 -179.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.5 p -111.19 23.4 14.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.996 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.56 ' CE3' ' HB3' ' A' ' 8' ' ' ALA . 5.9 m0 -58.3 -19.9 38.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.411 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.8 t -89.71 -51.58 5.44 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.821 0.343 . . . . 0.0 111.227 -179.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -88.82 8.69 27.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.566 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 52.5 -168.04 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.819 0.342 . . . . 0.0 111.077 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 152.11 -166.4 31.0 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.531 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.413 HG23 ' HA ' ' A' ' 42' ' ' TYR . 21.4 t -119.7 92.63 2.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.814 0.34 . . . . 0.0 111.033 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 51.2 t -74.27 101.88 4.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.965 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.64 -163.89 1.44 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.763 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -78.0 136.92 38.04 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.865 0.364 . . . . 0.0 110.955 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.7 mttt -58.48 -27.08 64.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.978 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.6 t -107.09 35.6 2.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.738 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -74.61 168.79 19.09 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 121.132 0.491 . . . . 0.0 110.407 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.08 16.14 16.04 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.492 -179.547 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -150.2 31.51 0.68 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.882 0.372 . . . . 0.0 110.648 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.7 146.65 23.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.115 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.422 ' CB ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -95.96 167.21 12.91 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.81 179.962 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.422 ' HD2' ' CB ' ' A' ' 25' ' ' LYS . 9.5 Cg_endo -50.8 87.82 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.66 2.24 . . . . 0.0 112.417 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.405 ' N ' ' O ' ' A' ' 25' ' ' LYS . 5.4 ppp? -60.48 166.43 3.13 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.207 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -123.3 177.08 5.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.948 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 63.4 p-90 -48.08 -28.85 3.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.248 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 26.6 p -67.88 148.94 50.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.857 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 41.5 p90 -136.21 -177.53 4.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.907 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.81 -70.87 0.64 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.908 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 179.16 -44.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.766 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -90.06 144.04 26.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.863 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -67.21 -10.92 55.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.839 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -89.97 -21.97 22.16 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.139 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 71.2 mm-40 -123.72 143.14 50.46 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.942 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -130.31 160.79 32.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.001 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.8 t -93.37 106.07 18.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.711 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 m -86.2 175.08 8.69 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.958 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.416 ' HB3' ' HB3' ' A' ' 25' ' ' LYS . 2.0 tp10 -63.56 115.87 5.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.947 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.413 ' HA ' HG23 ' A' ' 15' ' ' VAL . 38.3 p90 . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.214 -0.898 . . . . 0.0 112.144 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.3 mtt . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.643 0.259 . . . . 0.0 110.745 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 175.11 151.64 0.11 Allowed 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 120.828 0.346 . . . . 0.0 110.904 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.93 165.95 8.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.194 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 11.8 p -102.32 28.02 6.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.889 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 18.7 m0 -56.03 -28.78 58.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.203 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.2 t -89.97 -64.4 1.14 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.018 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 64.9 t-80 -57.07 -28.67 62.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.038 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.8 p 62.78 121.54 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.012 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -135.48 -133.27 3.23 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.467 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.419 HG12 ' HD3' ' A' ' 17' ' ' ARG . 21.5 t -144.22 85.52 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.758 0.314 . . . . 0.0 111.236 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.1 t -70.07 96.56 1.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.736 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.419 ' HD3' HG12 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -126.54 -162.92 1.18 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.745 -179.953 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 1.1 m-20 -77.37 132.79 38.73 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.95 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -50.8 -29.54 11.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.972 0.415 . . . . 0.0 110.876 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.0 t -104.22 32.39 4.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.979 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 10.9 tp10 -67.68 140.42 56.8 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.338 0.59 . . . . 0.0 110.295 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.85 14.61 15.02 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.621 -179.294 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -150.35 34.47 0.64 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.822 0.344 . . . . 0.0 110.8 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -94.1 162.62 13.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.321 -179.498 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.44 ' CD ' ' HD2' ' A' ' 26' ' ' PRO . 22.5 mmtm -115.94 164.25 18.36 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.621 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.44 ' HD2' ' CD ' ' A' ' 25' ' ' LYS . 9.1 Cg_endo -50.69 90.25 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.571 2.181 . . . . 0.0 112.572 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.41 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 0.7 OUTLIER -57.0 164.98 1.38 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.19 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -117.69 178.03 4.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.058 179.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.5 ' CH2' HG22 ' A' ' 30' ' ' THR . 38.5 p-90 -48.07 -29.75 3.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.344 -179.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.5 HG22 ' CH2' ' A' ' 29' ' ' TRP . 29.1 p -58.3 150.41 22.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.034 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -127.18 176.69 7.19 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.916 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 25.7 t -103.31 -67.07 0.9 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.895 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.1 tp10 -178.77 -63.99 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.733 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 20.4 t30 -89.96 149.82 22.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.796 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.1 mmp_? -67.69 -8.45 35.21 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.079 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 36.4 t-20 -89.66 -23.11 21.97 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.805 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -120.04 130.5 54.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.487 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.91 145.57 47.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.307 -179.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.9 t -83.31 97.26 8.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.644 179.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.41 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.8 OUTLIER -71.55 170.44 13.36 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.934 -179.697 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.425 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 2.6 tt0 -93.72 116.9 29.41 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.188 -179.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.409 ' C ' ' O ' ' A' ' 41' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.261 -0.876 . . . . 0.0 112.449 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 7.0 mtt . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.76 0.314 . . . . 0.0 110.981 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 168.01 -171.34 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.79 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.43 ' HB2' ' CE1' ' A' ' 31' ' ' TYR . . . -85.17 174.24 9.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.986 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 12.1 m -97.19 21.71 9.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.12 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 9.1 m0 -56.85 -32.77 66.12 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.821 0.344 . . . . 0.0 111.016 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.3 t -97.69 -43.78 7.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.981 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.894 ' CD2' HG21 ' A' ' 30' ' ' THR . 37.2 m-70 -58.1 -31.6 67.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.947 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t 62.33 31.34 17.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.086 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.96 -164.27 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.217 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.493 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 1.1 t -116.74 94.44 3.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.938 0.399 . . . . 0.0 110.994 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.3 t -67.34 106.7 2.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.984 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.7 -158.65 0.65 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.657 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.27 142.41 27.44 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.838 0.351 . . . . 0.0 110.803 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.06 -37.54 69.42 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.889 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.6 t -74.94 -11.47 60.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.131 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -98.81 92.48 5.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.807 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.42 ' CD ' ' N ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -97.06 40.63 1.14 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.893 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.12 -26.84 20.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.968 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.98 177.87 6.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.789 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.53 144.12 92.76 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.747 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -88.18 95.41 0.4 Allowed 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.937 2.424 . . . . 0.0 112.8 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.451 ' HG2' ' NE1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -76.22 100.92 5.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.644 179.628 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -102.46 55.64 0.78 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.011 0.434 . . . . 0.0 111.657 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.851 ' CE3' HG23 ' A' ' 30' ' ' THR . 5.1 p-90 -168.1 -43.6 0.02 OUTLIER 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.481 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.894 HG21 ' CD2' ' A' ' 12' ' ' HIS . 7.7 p -101.33 168.87 9.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.703 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.43 ' CE1' ' HB2' ' A' ' 8' ' ' ALA . 23.2 p90 -140.09 166.06 25.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.191 -179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 35.7 t -89.92 -75.08 0.46 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.937 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -176.0 -46.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.786 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 33.0 t-20 -101.91 145.64 28.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.749 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -69.49 -8.67 48.97 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.868 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 -89.99 -17.22 28.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.145 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 9.2 mp0 -106.59 166.34 10.63 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.905 0.383 . . . . 0.0 110.872 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.02 113.97 8.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.732 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 9.1 t -59.34 136.89 58.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.943 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.493 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 13.3 t -97.97 136.23 38.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.677 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.82 89.69 4.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.938 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 30.0 p90 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.238 -0.887 . . . . 0.0 112.114 -179.603 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 2.8 mmm . . . . . 0 CA--C 1.531 0.225 0 CA-C-O 120.502 0.191 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -175.71 146.19 0.74 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 120.819 0.343 . . . . 0.0 110.825 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.728 ' HB3' ' CD1' ' A' ' 10' ' ' TRP . . . -55.09 177.26 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.244 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.02 8.89 27.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.215 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.728 ' CD1' ' HB3' ' A' ' 8' ' ' ALA . 8.0 m95 -54.57 -29.84 52.49 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.816 0.341 . . . . 0.0 111.091 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.6 t -108.65 40.07 1.87 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.918 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -164.26 -51.25 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.863 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 61.64 100.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.897 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -119.6 -117.09 2.62 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.478 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.593 HG23 ' HA ' ' A' ' 42' ' ' TYR . 21.7 t -132.45 80.42 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.855 0.36 . . . . 0.0 111.15 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.3 t -72.49 89.54 1.27 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.639 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -140.49 -166.58 2.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.768 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.456 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 11.8 t70 -66.17 136.11 55.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.864 0.364 . . . . 0.0 110.695 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.8 mtmm -60.69 -29.54 69.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.736 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.6 t -107.66 35.77 2.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.605 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.456 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 0.5 OUTLIER -75.46 -164.5 0.34 Allowed 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.4 -179.982 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -118.99 18.16 13.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.695 0.283 . . . . 0.0 111.201 -179.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -148.18 35.7 0.82 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.876 0.37 . . . . 0.0 110.69 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -97.29 126.94 42.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.999 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.3 mtpp -113.08 163.56 17.76 Favored Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.964 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.74 91.67 0.09 OUTLIER 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.55 2.167 . . . . 0.0 112.58 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . 0.465 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -77.97 171.72 14.57 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.175 0.512 . . . . 0.0 111.286 179.812 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.482 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -122.76 108.9 13.56 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.437 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.505 ' CE2' HG22 ' A' ' 30' ' ' THR . 9.3 p-90 37.49 -159.32 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.098 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.505 HG22 ' CE2' ' A' ' 29' ' ' TRP . 3.0 p 65.4 157.37 0.1 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.737 0.303 . . . . 0.0 110.592 -179.216 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 31.4 p90 -136.72 175.38 9.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.092 -179.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.7 t -98.38 -73.58 0.61 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.987 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -179.59 -51.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.868 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -90.0 136.7 32.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.881 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -69.74 -6.73 33.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.807 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -89.96 -19.21 24.76 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.879 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -131.22 141.53 50.05 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.892 0.377 . . . . 0.0 110.801 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.36 158.59 23.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.835 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 9.8 t -89.99 80.76 6.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.815 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.465 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.0 OUTLIER -65.3 171.23 3.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.779 179.955 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.41 ' N ' ' HB3' ' A' ' 27' ' ' MET . 7.7 tp10 -63.86 120.72 12.45 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.061 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.593 ' HA ' HG23 ' A' ' 15' ' ' VAL . 2.9 p90 . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.235 -0.888 . . . . 0.0 112.045 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 3.5 pt . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.851 0.358 . . . . 0.0 111.129 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -132.0 29.65 4.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.926 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 20.6 p90 173.73 -35.94 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.872 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.36 85.26 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.841 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -44.12 -74.45 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.562 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 35.6 mtm -85.44 -165.02 1.1 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.787 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 172.57 172.45 0.11 Allowed 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.793 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.36 176.44 0.25 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.133 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.2 p -111.11 29.68 7.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.969 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 9.3 m0 -54.55 -31.97 57.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.18 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.0 t -97.45 -57.92 2.13 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.987 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.537 ' CB ' HG21 ' A' ' 30' ' ' THR . 21.3 t-80 -57.85 -26.8 62.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.054 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.97 163.46 0.1 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.935 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 164.88 174.46 34.63 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.556 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.431 HG23 ' HA ' ' A' ' 42' ' ' TYR . 21.5 t -91.94 105.66 16.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.854 0.359 . . . . 0.0 111.122 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.9 t -79.02 96.09 5.68 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.84 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.2 -164.3 1.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.888 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 77.1 m-20 -74.46 138.55 43.32 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.86 0.362 . . . . 0.0 111.214 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.405 ' HA ' ' HG2' ' A' ' 38' ' ' LYS . 0.7 OUTLIER -52.52 -29.25 24.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.2 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.0 t -103.87 33.45 3.42 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.002 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 8.6 tt0 -65.44 133.99 52.48 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 121.287 0.565 . . . . 0.0 110.641 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.65 14.73 7.89 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.404 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.18 38.5 0.72 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.001 0.429 . . . . 0.0 110.39 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.98 154.51 19.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.17 -179.48 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.441 ' CB ' ' CD ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -105.54 179.08 0.98 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.876 -179.896 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.441 ' CD ' ' CB ' ' A' ' 25' ' ' LYS . 33.1 Cg_exo -59.91 80.22 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.514 2.143 . . . . 0.0 112.402 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.404 ' CB ' ' HA ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -55.84 164.03 1.27 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.05 179.932 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -124.78 177.55 5.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.059 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 65.7 p-90 -47.55 -29.91 3.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.397 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.537 HG21 ' CB ' ' A' ' 12' ' ' HIS . 20.0 p -65.48 151.99 45.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.907 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 28.4 p90 -137.06 -179.14 5.53 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.887 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.5 t -89.92 -66.29 0.94 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.828 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 178.53 -56.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.66 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -89.98 150.16 22.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.742 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -69.15 -8.03 41.73 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.933 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -89.76 -19.79 24.32 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.003 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 58.6 mm-40 -125.76 131.6 52.48 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.774 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.405 ' HG2' ' HA ' ' A' ' 19' ' ' LYS . 5.2 ptpt -117.3 153.56 32.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.154 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.9 t -96.33 94.63 7.56 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.609 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.404 ' HA ' ' CB ' ' A' ' 27' ' ' MET . 0.8 OUTLIER -76.9 177.19 7.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.082 -179.816 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.81 115.94 11.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.886 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.431 ' HA ' HG23 ' A' ' 15' ' ' VAL . 15.6 p90 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.227 -0.892 . . . . 0.0 112.118 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 1.6 pt . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.863 0.364 . . . . 0.0 111.101 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 40.9 mtp -150.97 138.22 19.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.889 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 4.2 t80 60.76 64.77 1.11 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.843 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -121.64 -40.32 2.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.925 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 56.27 95.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.864 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 3.5 mmt -101.54 175.16 5.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.869 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 175.99 170.72 0.39 Allowed 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.833 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.4 ' HB3' ' CD1' ' A' ' 10' ' ' TRP . . . -68.45 -172.93 0.38 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.049 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.2 p -117.1 24.85 10.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.993 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.4 ' CD1' ' HB3' ' A' ' 8' ' ' ALA . 7.8 m95 -57.36 -27.3 62.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.142 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.7 t -89.94 -32.88 16.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.969 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -80.03 -29.62 39.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.845 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.6 m 62.12 84.31 0.14 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.913 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -113.82 -145.39 9.1 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.837 -0.696 . . . . 0.0 112.477 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.494 HG23 ' HA ' ' A' ' 42' ' ' TYR . 21.4 t -131.13 102.65 6.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.822 0.344 . . . . 0.0 111.082 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.9 t -79.81 103.27 9.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.952 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.12 -165.48 1.37 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.66 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.479 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 9.0 t70 -71.27 136.53 47.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.962 0.411 . . . . 0.0 110.972 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.423 ' HA ' ' HG2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -49.97 -36.35 27.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.027 0.441 . . . . 0.0 111.049 -179.992 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.6 t -101.43 31.85 3.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.966 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.479 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 7.6 tp10 -61.94 129.95 43.33 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.214 0.531 . . . . 0.0 110.447 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.6 16.2 4.07 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.632 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -150.18 40.19 0.78 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.99 0.424 . . . . 0.0 110.374 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.85 147.79 23.56 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.215 -179.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.466 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 0.1 OUTLIER -98.2 172.08 5.2 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.638 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.466 ' HD2' ' HB3' ' A' ' 25' ' ' LYS . 45.3 Cg_exo -57.11 83.38 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.447 2.098 . . . . 0.0 112.541 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.553 ' HE2' ' HD3' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -54.67 168.19 0.3 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.253 179.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -120.26 173.17 7.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.867 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.634 ' CH2' HG22 ' A' ' 30' ' ' THR . 46.6 p-90 -47.07 -29.02 1.93 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.408 -179.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.634 HG22 ' CH2' ' A' ' 29' ' ' TRP . 44.3 p -65.33 165.1 12.3 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.087 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -135.39 -179.41 5.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.842 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 49.0 t -93.39 -78.65 0.42 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.007 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -179.49 -51.44 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.01 -179.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -89.87 144.27 26.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.888 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -66.75 -12.06 57.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.686 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -90.07 -22.63 21.72 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.126 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 6.6 mp0 -128.06 138.55 52.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.79 0.329 . . . . 0.0 111.059 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.553 ' HD3' ' HE2' ' A' ' 27' ' ' MET . 0.0 OUTLIER -123.28 158.36 31.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.043 -179.903 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 33.9 t -90.52 113.67 25.7 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.957 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -98.51 179.45 4.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.788 -179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.408 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -63.9 127.26 30.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.786 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.494 ' HA ' HG23 ' A' ' 15' ' ' VAL . 29.0 p90 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.232 -0.889 . . . . 0.0 112.17 -179.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 11.3 pt . . . . . 0 N--CA 1.485 1.299 0 CA-C-O 120.866 0.365 . . . . 0.0 111.132 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 22.9 mtm -110.75 128.46 55.74 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.853 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 1.5 t80 177.93 -50.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.857 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 36.0 m-85 -80.0 115.74 19.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.895 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -43.42 -51.55 6.49 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.542 -179.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 8.8 mmm -78.91 179.59 7.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.894 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 168.42 155.03 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.795 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.81 166.67 2.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.021 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 29.3 p -105.09 20.06 19.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.25 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -57.52 -27.99 63.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.762 0.315 . . . . 0.0 111.092 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.9 t -90.09 -64.6 1.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.951 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.5 -23.93 59.22 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.154 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 66.21 147.85 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.931 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -171.35 -164.68 27.43 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.526 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.5 t -115.96 95.97 4.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.814 0.34 . . . . 0.0 111.148 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.4 t -72.02 95.84 1.65 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.778 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.4 -168.04 1.99 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.774 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -74.9 136.78 41.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.8 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.7 mttm -53.83 -28.06 33.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.918 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 29.3 t -105.31 34.53 3.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.739 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -73.22 149.29 42.95 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.297 0.57 . . . . 0.0 110.616 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -98.65 17.57 18.89 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.127 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -148.01 28.93 0.91 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.833 0.349 . . . . 0.0 110.682 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.35 147.47 23.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.995 -179.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.443 ' HB3' ' HB3' ' A' ' 41' ' ' GLU . 1.1 mptp? -101.07 177.54 1.49 Allowed Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.747 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.411 ' CD ' ' CB ' ' A' ' 25' ' ' LYS . 47.5 Cg_exo -56.67 82.86 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.434 2.089 . . . . 0.0 112.525 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.406 ' N ' ' O ' ' A' ' 25' ' ' LYS . 5.5 ppp? -52.82 164.42 0.38 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.299 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -124.49 174.53 7.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.051 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.471 ' CH2' HG22 ' A' ' 30' ' ' THR . 55.2 p-90 -49.16 -30.66 7.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.287 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.471 HG22 ' CH2' ' A' ' 29' ' ' TRP . 13.2 p -58.66 158.24 8.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.899 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -129.46 172.38 11.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.859 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 40.8 t -90.03 -73.78 0.51 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.937 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -179.13 -49.1 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.736 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -89.97 140.91 29.17 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.787 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -70.53 -6.98 40.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.946 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -89.91 -14.03 35.05 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.17 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.41 161.59 35.03 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.801 0.334 . . . . 0.0 110.787 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 16.0 ptpt -130.54 162.53 29.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.113 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.6 t -99.91 104.77 16.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.86 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 m -81.31 176.87 9.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.737 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.443 ' HB3' ' HB3' ' A' ' 25' ' ' LYS . 0.3 OUTLIER -71.05 116.62 11.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.717 179.908 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 1.8 p90 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.245 -0.884 . . . . 0.0 112.198 -179.512 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 4.6 tp . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 120.748 0.308 . . . . 0.0 111.083 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.95 -42.23 5.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.884 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -179.89 -39.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.891 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -171.3 -58.09 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.864 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.407 ' O ' ' CE3' ' A' ' 29' ' ' TRP . 0.6 OUTLIER 177.83 88.58 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.73 179.662 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 72.3 mtp -102.26 152.23 21.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.16 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.451 ' N ' ' CE2' ' A' ' 31' ' ' TYR . 0.0 OUTLIER 174.58 157.62 0.16 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.723 179.728 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.79 156.81 10.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.235 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.6 p -115.1 25.8 10.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.966 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 11.8 m0 -55.45 -38.44 69.05 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.131 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -108.26 30.35 6.49 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.046 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -147.36 21.21 1.2 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.146 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 53.25 178.84 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.781 0.324 . . . . 0.0 111.025 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 145.42 171.79 15.32 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.615 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.4 t -120.19 85.12 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.837 0.351 . . . . 0.0 111.074 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 52.7 t -61.69 94.78 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.976 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.58 -163.63 0.92 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.624 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -88.59 137.73 32.06 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.738 0.304 . . . . 0.0 110.897 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.1 mtpp -50.86 -30.77 15.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.913 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.9 t -99.23 25.12 7.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.851 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -60.51 118.26 6.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.087 0.47 . . . . 0.0 110.565 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.29 12.31 18.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.558 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -150.08 40.13 0.78 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.169 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -98.84 179.17 4.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.609 -179.181 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.7 mmtt -115.18 164.69 16.13 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.289 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -50.52 90.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.483 2.122 . . . . 0.0 112.651 -179.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.42 ' CB ' ' HA ' ' A' ' 40' ' ' CYS . 0.1 OUTLIER -60.15 168.54 1.91 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.98 179.727 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -122.26 174.3 7.07 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.931 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.763 ' CH2' HG22 ' A' ' 30' ' ' THR . 37.5 p-90 -49.38 -26.76 3.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.451 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.763 HG22 ' CH2' ' A' ' 29' ' ' TRP . 15.7 p -66.94 157.92 32.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.85 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.451 ' CE2' ' N ' ' A' ' 7' ' ' GLN . 15.1 p90 -137.37 177.51 7.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.967 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 4.1 t -89.92 -67.37 0.85 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.986 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -179.45 -53.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.701 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 55.3 t30 -90.0 152.44 21.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.751 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -66.79 -11.55 55.52 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.824 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -90.01 -22.64 21.78 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.082 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -114.87 134.35 55.21 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.753 0.311 . . . . 0.0 110.992 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.415 ' NZ ' ' HG2' ' A' ' 27' ' ' MET . 0.0 OUTLIER -122.63 154.82 37.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.121 179.976 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 9.0 t -87.5 99.28 11.91 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.589 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.42 ' HA ' ' CB ' ' A' ' 27' ' ' MET . 0.7 OUTLIER -79.83 174.84 11.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.302 -179.548 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -58.13 106.77 0.4 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.005 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 10.5 p90 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.235 -0.888 . . . . 0.0 112.053 -179.584 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.562 ' O ' HG23 ' A' ' 1' ' ' ILE . 11.3 tt . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.895 0.379 . . . . 0.0 111.101 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.1 ptt? -140.8 -57.96 0.51 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.892 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -55.99 -171.94 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.22 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -154.39 142.87 20.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.839 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 54.68 69.68 0.7 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.081 179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 30.6 mmm -101.56 -166.82 1.34 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.752 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 169.94 179.82 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.817 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.515 ' HB3' ' NE1' ' A' ' 10' ' ' TRP . . . -100.51 -177.21 3.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.133 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 27.3 p -109.89 27.77 9.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.0 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.515 ' NE1' ' HB3' ' A' ' 8' ' ' ALA . 9.7 m95 -54.49 -31.25 55.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.033 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 28.4 t -97.3 -52.2 3.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.849 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 32.4 m80 -59.62 -25.95 65.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.945 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.5 p 63.32 143.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.974 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -165.87 -134.48 1.68 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.5 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.436 ' CG2' ' HA ' ' A' ' 42' ' ' TYR . 21.8 t -141.06 82.02 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.859 0.362 . . . . 0.0 111.068 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.0 t -66.37 89.32 0.14 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.808 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.18 -166.26 1.2 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.738 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.66 136.23 41.92 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.825 0.345 . . . . 0.0 110.91 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.4 mttt -63.53 -34.95 78.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.653 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.1 t -104.79 34.76 3.02 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.41 179.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.85 -175.63 3.55 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.351 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -123.04 17.96 10.04 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.496 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.02 40.0 0.78 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.88 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -97.14 146.97 24.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.039 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.491 ' CB ' ' HD2' ' A' ' 26' ' ' PRO . 1.0 OUTLIER -106.15 170.83 5.37 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.763 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.491 ' HD2' ' CB ' ' A' ' 25' ' ' LYS . 9.5 Cg_endo -52.49 87.72 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.393 2.062 . . . . 0.0 112.246 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.402 ' N ' ' O ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -62.46 165.77 5.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.137 -179.902 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -115.13 177.69 4.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.012 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 64.1 p-90 -49.97 -36.18 27.19 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.292 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 19.1 p -58.92 148.78 29.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.967 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 16.8 p90 -130.68 179.96 5.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.917 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.5 t -94.43 -69.5 0.75 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.892 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.4 pp20? 178.54 -46.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.862 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -96.66 146.87 24.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.862 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -69.14 -8.3 44.24 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.871 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -89.8 -19.28 24.88 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.059 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -129.39 141.12 51.14 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.812 0.339 . . . . 0.0 110.853 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -131.78 158.06 42.22 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.095 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 17.8 t -86.26 93.15 8.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.591 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -82.07 166.41 19.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.975 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.88 139.23 52.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.935 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.436 ' HA ' ' CG2' ' A' ' 15' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.237 -0.887 . . . . 0.0 112.277 -179.587 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 8.9 tp . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.787 0.327 . . . . 0.0 111.065 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 4.1 mmt -133.18 133.84 43.33 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.883 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 60.13 40.1 18.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.913 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -164.67 -163.34 0.72 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.876 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 179.28 98.21 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 120.893 0.377 . . . . 0.0 110.915 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 8.3 mtt -70.25 -173.19 0.66 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.88 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 178.05 -172.45 0.12 Allowed 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.924 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.59 157.29 35.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.254 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 8.5 p -107.89 25.45 11.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.97 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 18.1 m0 -55.99 -32.1 63.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.256 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.0 t -89.98 -34.3 16.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.962 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -70.0 -16.42 63.17 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.276 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 67.34 126.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.859 0.361 . . . . 0.0 110.929 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -172.87 -167.8 33.3 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.825 -0.703 . . . . 0.0 112.288 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.424 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 24.4 t -122.84 95.16 3.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.967 0.413 . . . . 0.0 111.166 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.7 t -62.51 86.25 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.894 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.38 -163.21 1.02 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.765 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -96.07 142.01 28.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.842 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.16 -40.69 90.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.894 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.7 t -73.42 -11.89 60.62 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.136 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -102.62 95.14 6.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.829 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.43 ' CD ' ' N ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -97.67 40.29 1.17 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.967 -179.794 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -98.35 24.76 6.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.96 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -121.69 -173.73 2.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.683 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.26 155.4 84.14 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.645 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -64.16 103.33 0.42 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.418 2.079 . . . . 0.0 112.328 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 12.6 ptm -60.81 163.62 5.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.129 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.437 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -134.41 104.76 6.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.824 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.437 ' CD1' ' O ' ' A' ' 28' ' ' ALA . 0.5 OUTLIER 47.75 -178.71 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.418 -179.815 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 63.37 161.72 0.1 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.633 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -139.32 -178.86 5.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.945 0.402 . . . . 0.0 111.229 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 36.1 t -89.84 -64.03 1.2 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.762 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -178.47 -44.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.679 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 60.5 t30 -107.89 150.49 26.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.663 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -69.85 -7.0 36.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.926 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -89.74 -17.83 27.51 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.965 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -119.13 149.34 41.87 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.817 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -121.52 162.43 20.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.952 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 15.4 t -95.82 83.21 3.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.825 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.424 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -55.7 154.04 7.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.668 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.65 107.99 5.43 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.059 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 28.4 p90 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.079 -179.6 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.505 ' O ' HG23 ' A' ' 1' ' ' ILE . 1.2 tp . . . . . 0 N--CA 1.487 1.424 0 CA-C-O 120.815 0.341 . . . . 0.0 111.232 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 6.9 mmt -126.16 146.53 49.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.898 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 5.8 t80 60.34 79.13 0.25 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.895 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -112.27 151.0 30.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.931 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -43.28 -32.98 0.88 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.42 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 40.2 mtt -75.73 -174.36 2.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.869 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 175.53 160.41 0.25 Allowed 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.918 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.37 153.66 40.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.184 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.5 p -113.81 19.6 16.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.18 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 50.3 m0 -56.51 -44.74 81.04 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.831 0.348 . . . . 0.0 111.082 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.85 -20.21 23.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.239 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 13.0 m-70 -96.18 24.28 5.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.069 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.0 t 56.95 179.95 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.989 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 139.24 166.0 10.45 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.476 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.486 HG23 ' HA ' ' A' ' 42' ' ' TYR . 21.2 t -116.1 87.86 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.868 0.366 . . . . 0.0 111.17 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 49.5 t -67.05 99.69 0.68 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.939 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.51 -164.65 1.12 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.603 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -83.1 138.3 33.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.824 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.1 mttm -49.76 -29.81 8.37 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.949 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.8 t -103.4 28.17 6.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.711 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 -60.63 117.52 5.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.715 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.76 12.92 13.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.446 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -149.29 42.67 0.93 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.204 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -104.21 173.18 6.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.479 -179.112 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -104.34 168.13 8.98 Favored Pre-proline 0 C--N 1.332 -0.189 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.546 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.78 93.57 0.32 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.48 2.12 . . . . 0.0 112.545 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.482 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 3.5 ptm -59.24 168.77 1.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.38 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.49 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -147.95 109.42 4.37 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.02 179.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.983 ' CE2' HG23 ' A' ' 30' ' ' THR . 2.8 p-90 38.58 -159.1 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.277 -179.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.983 HG23 ' CE2' ' A' ' 29' ' ' TRP . 2.1 p 51.73 -179.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.864 0.364 . . . . 0.0 111.294 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.2 p90 -154.69 179.59 8.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.733 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 41.1 t -90.29 -72.72 0.55 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.797 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -178.61 -39.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.711 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -107.5 147.91 29.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.775 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.3 mmp_? -67.98 -8.79 40.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.983 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -89.82 -22.2 22.21 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.003 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -123.45 144.04 49.76 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.803 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -122.09 157.11 32.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.185 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 16.9 t -85.53 117.41 24.41 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.547 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.482 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.6 OUTLIER -96.57 176.6 5.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.328 -179.544 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.93 105.2 2.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.965 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.486 ' HA ' HG23 ' A' ' 15' ' ' VAL . 1.7 p90 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.224 -0.893 . . . . 0.0 112.084 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 2.6 pt . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.786 0.327 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -176.7 149.48 0.76 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.927 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 63.15 145.41 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.885 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -167.57 83.08 0.21 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.858 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -43.44 -34.64 1.36 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.561 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.441 ' HB3' ' CD2' ' A' ' 31' ' ' TYR . 6.0 mmt -83.38 -178.36 7.04 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.974 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.759 ' O ' HG22 ' A' ' 30' ' ' THR . 6.3 tp60 177.76 159.63 0.47 Allowed 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.771 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.6 147.33 32.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.048 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 15.1 p -95.08 18.61 11.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.216 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 20.4 m0 -57.33 -42.93 82.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.818 0.342 . . . . 0.0 111.013 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.38 -20.36 22.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.278 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -95.39 23.26 6.07 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.267 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.6 m 57.78 -168.46 0.12 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.033 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.402 ' N ' ' HB3' ' A' ' 42' ' ' TYR . . . 116.72 156.84 10.74 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.304 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.476 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 34.4 t -112.64 85.93 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.965 0.412 . . . . 0.0 111.07 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 46.4 t -57.56 100.64 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.178 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -119.27 -159.72 0.78 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.468 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -84.88 144.27 28.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.912 0.386 . . . . 0.0 110.967 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.6 mmtm -49.09 -27.35 3.31 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.244 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.41 ' O ' ' CD ' ' A' ' 22' ' ' ARG . 12.4 t -94.1 29.77 2.06 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.743 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.58 114.28 2.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.987 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.41 ' CD ' ' O ' ' A' ' 20' ' ' SER . 0.0 OUTLIER -115.64 19.15 15.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.194 179.839 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -123.38 -32.12 3.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.705 0.288 . . . . 0.0 111.392 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.7 -171.3 3.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.828 0.347 . . . . 0.0 110.893 -179.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.3 mtpt -98.33 167.69 11.12 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.93 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -66.9 123.16 10.64 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.535 2.156 . . . . 0.0 112.311 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.5 153.66 15.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.002 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -130.94 102.23 5.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.919 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.412 ' CD1' ' OG1' ' A' ' 30' ' ' THR . 0.0 OUTLIER 54.28 173.29 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.814 -179.858 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.759 HG22 ' O ' ' A' ' 7' ' ' GLN . 0.2 OUTLIER 67.02 162.9 0.18 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.549 -179.459 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.441 ' CD2' ' HB3' ' A' ' 6' ' ' MET . 8.0 p90 -135.56 169.63 17.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.965 0.412 . . . . 0.0 110.948 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 41.1 t -89.92 -64.14 1.18 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.782 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -178.38 -49.16 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.643 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -106.75 148.61 28.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.684 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -69.25 -7.34 35.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.927 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -89.95 -19.31 24.65 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.112 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 9.5 mp0 -109.8 148.24 31.83 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.833 0.349 . . . . 0.0 111.03 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.5 132.4 53.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.857 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.6 t -77.87 97.3 5.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.992 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.476 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -57.47 154.26 11.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.761 179.85 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -57.96 110.0 0.84 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.995 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.402 ' HB3' ' N ' ' A' ' 14' ' ' GLY . 13.9 p90 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.231 -0.89 . . . . 0.0 112.045 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 30.1 mm . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.832 0.348 . . . . 0.0 111.079 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.95 -64.93 1.18 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.804 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 16.7 t80 60.81 88.15 0.08 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.944 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -105.12 115.23 29.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.853 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -43.58 -56.57 3.62 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.614 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 3.9 mtp -156.33 -68.32 0.11 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.994 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 65.61 -176.16 0.18 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.837 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.44 ' HB3' ' CD1' ' A' ' 10' ' ' TRP . . . -96.71 -179.55 4.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.202 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.5 p -114.47 26.24 10.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.942 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.44 ' CD1' ' HB3' ' A' ' 8' ' ' ALA . 14.8 m95 -55.91 -47.63 77.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.078 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 47.4 t -98.23 30.96 2.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.94 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -145.49 29.43 1.14 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.806 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.8 m 58.35 -176.12 0.08 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.933 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 110.97 156.5 14.36 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.485 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.491 HG22 ' CE1' ' A' ' 42' ' ' TYR . 15.9 t -122.07 114.84 44.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.868 0.366 . . . . 0.0 111.135 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 37.5 t -70.08 87.03 0.56 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.954 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.75 -161.84 0.77 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.538 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -83.71 140.59 32.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.835 0.35 . . . . 0.0 110.827 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.47 -33.64 14.81 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.109 0.48 . . . . 0.0 111.075 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.6 t -100.33 27.0 6.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.943 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.417 ' CG ' ' HB2' ' A' ' 24' ' ' CYS . 4.2 tp10 -57.37 113.75 1.9 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.987 0.422 . . . . 0.0 110.671 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.62 23.83 7.37 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.403 -179.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -138.73 8.37 2.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.603 -0.272 . . . . 0.0 111.706 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.417 ' HB2' ' CG ' ' A' ' 21' ' ' GLU . 0.5 OUTLIER -131.53 167.11 19.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.587 0.232 . . . . 0.0 110.809 -179.695 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 18.0 mmtt -81.13 161.1 63.99 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 120.778 0.323 . . . . 0.0 110.96 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -57.86 124.26 15.58 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.624 2.216 . . . . 0.0 112.436 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -57.68 164.14 2.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.228 -179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.457 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -125.37 98.58 5.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.636 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.505 ' CE2' ' CG2' ' A' ' 30' ' ' THR . 7.0 p-90 36.87 -159.7 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.068 -0.514 . . . . 0.0 112.035 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.505 ' CG2' ' CE2' ' A' ' 29' ' ' TRP . 2.5 p 61.82 174.79 0.12 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.687 0.28 . . . . 0.0 110.406 -179.007 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 5.9 p90 -141.56 152.49 44.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.949 0.404 . . . . 0.0 111.122 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.3 t -89.85 -56.09 3.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.777 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -176.23 -46.38 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.563 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -109.4 151.53 26.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.639 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -67.58 -10.17 49.52 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 120.861 0.362 . . . . 0.0 111.789 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -91.17 -21.45 21.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.072 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -89.56 146.72 24.39 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.778 0.323 . . . . 0.0 111.069 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 8.0 ptpt -125.42 149.44 48.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.997 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 41.8 t -91.78 76.07 5.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.8 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 12.7 t -43.9 157.65 0.05 Allowed 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.388 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -95.46 102.09 13.86 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.822 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.491 ' CE1' HG22 ' A' ' 15' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.227 -0.892 . . . . 0.0 112.297 -179.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.579 ' O ' HG23 ' A' ' 1' ' ' ILE . 14.6 tt . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.973 0.416 . . . . 0.0 111.053 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -101.52 -53.67 2.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.888 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 33.9 p90 -48.36 162.77 0.08 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.255 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -130.52 116.9 18.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.898 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 178.21 -42.34 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.921 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.417 ' O ' ' HB2' ' A' ' 7' ' ' GLN . 35.4 mtp -88.26 -175.94 5.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.903 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 6' ' ' MET . 15.9 tt0 177.36 155.93 0.31 Allowed 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.788 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.46 161.34 9.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.179 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 3.8 p -120.16 10.27 11.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.213 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 16.9 m0 -54.59 -47.49 73.27 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.894 0.378 . . . . 0.0 111.103 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.68 31.12 6.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.837 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -138.29 38.9 2.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.906 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 52.0 m 61.95 115.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.936 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 156.97 149.17 5.32 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.531 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.8 t -126.58 94.86 2.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.893 0.378 . . . . 0.0 111.186 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 51.0 t -58.32 105.69 0.31 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.019 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.96 -166.54 1.18 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.809 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -89.07 133.48 34.35 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.887 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.34 -30.35 68.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.002 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 46.5 t -91.75 16.96 9.67 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.345 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -100.55 -42.51 6.53 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.732 0.301 . . . . 0.0 110.95 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 40.49 41.09 1.0 Allowed 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.869 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -110.94 13.57 22.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.13 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.4 t -132.43 178.64 6.67 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.788 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.403 ' CB ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -67.16 168.44 11.28 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.781 179.935 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.403 ' HD2' ' CB ' ' A' ' 25' ' ' LYS . 51.0 Cg_endo -69.4 119.31 6.29 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.531 2.154 . . . . 0.0 112.505 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.405 ' HG2' ' N ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -50.21 142.53 9.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.173 179.895 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.469 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -117.54 102.72 9.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.691 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.553 ' CE2' HG22 ' A' ' 30' ' ' THR . 5.9 p-90 36.79 -158.15 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.965 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.553 HG22 ' CE2' ' A' ' 29' ' ' TRP . 3.0 p 64.76 176.86 0.19 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.74 0.305 . . . . 0.0 110.59 -179.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.416 ' CE2' ' N ' ' A' ' 7' ' ' GLN . 6.7 p90 -140.39 153.13 46.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.07 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 38.0 t -97.84 -72.01 0.66 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.726 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -176.83 -48.82 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.751 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -103.19 138.13 40.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.752 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.4 mmp_? -68.52 -6.99 28.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.792 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -98.18 12.92 33.01 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.186 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 63.2 mm-40 -126.87 162.12 26.67 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.866 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -133.22 129.2 37.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.961 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.7 t -76.91 89.89 3.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.038 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 4.4 t -46.2 156.0 0.18 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.12 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -123.66 56.32 1.22 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.931 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 2.3 p90 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.22 -0.895 . . . . 0.0 112.095 -179.505 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 3.7 mp . . . . . 0 N--CA 1.485 1.287 0 CA-C-O 120.868 0.366 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 58.7 23.8 11.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.077 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 1.8 t80 177.23 150.68 0.18 Allowed 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.851 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -121.49 -77.27 0.58 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.83 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.412 ' O ' ' CG ' ' A' ' 5' ' ' GLU . 14.3 tt0 47.83 28.31 1.32 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.289 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.1 mtp -153.16 177.35 10.92 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.015 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.477 ' O ' HG22 ' A' ' 30' ' ' THR . 4.8 mt-30 166.8 170.58 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.726 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.454 ' CB ' ' CD1' ' A' ' 10' ' ' TRP . . . -59.69 151.35 25.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.061 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 27.6 p -96.96 23.95 6.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.259 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.454 ' CD1' ' CB ' ' A' ' 8' ' ' ALA . 15.8 m95 -55.89 -36.22 67.41 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.865 0.364 . . . . 0.0 110.971 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 t -89.99 -44.33 9.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.793 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -63.62 -27.77 69.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.89 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.1 p 63.8 137.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.017 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -169.47 -159.24 14.73 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.271 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.428 ' O ' ' HB2' ' A' ' 40' ' ' CYS . 25.1 t -128.23 83.87 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.951 0.405 . . . . 0.0 111.212 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.4 t -58.8 95.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.934 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.02 -161.89 0.99 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.812 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.403 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 0.2 OUTLIER -83.74 137.64 33.65 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.889 0.375 . . . . 0.0 110.832 179.992 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -50.71 -27.33 6.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.057 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.1 t -99.56 27.06 5.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.1 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.423 ' HB3' ' HB2' ' A' ' 24' ' ' CYS . 21.7 tp10 -60.4 118.5 6.54 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 121.012 0.434 . . . . 0.0 110.383 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.61 13.1 14.87 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.712 -0.677 . . . . 0.0 111.79 -179.154 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -150.26 43.96 0.87 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.904 0.383 . . . . 0.0 110.519 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.423 ' HB2' ' HB3' ' A' ' 21' ' ' GLU . 0.1 OUTLIER -116.63 -178.58 3.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.587 -178.983 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.72 166.7 15.68 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.602 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.02 109.23 2.84 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.58 2.187 . . . . 0.0 112.714 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.468 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -75.3 171.81 13.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.329 179.825 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.487 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -127.47 110.02 12.34 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.496 179.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.689 ' CZ2' HG23 ' A' ' 30' ' ' THR . 2.2 p-90 41.91 -167.43 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.869 -179.587 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.689 HG23 ' CZ2' ' A' ' 29' ' ' TRP . 0.2 OUTLIER 56.61 167.44 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.749 -179.231 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 46.7 p90 -140.24 179.17 6.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.926 0.394 . . . . 0.0 111.201 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 30.9 t -89.94 -71.45 0.61 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.691 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -179.47 -56.42 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.68 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 31.4 t-20 -90.27 141.82 28.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.658 179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.3 mmp_? -68.16 -7.3 28.86 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.277 -0.419 . . . . 0.0 112.022 -179.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -89.71 -22.74 22.07 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.801 179.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -124.7 139.15 54.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.685 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.67 143.7 45.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.054 -179.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 8.2 t -75.9 105.0 6.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.611 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.468 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.3 OUTLIER -72.76 177.74 4.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.23 -179.817 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.94 118.8 22.02 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.913 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 27.5 p90 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.239 -0.886 . . . . 0.0 112.129 -179.559 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.425 HD12 ' HB2' ' A' ' 2' ' ' MET . 2.5 pp . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.783 0.325 . . . . 0.0 111.099 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.425 ' HB2' HD12 ' A' ' 1' ' ' ILE . 2.1 tpt 60.93 94.41 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.926 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 60.64 97.63 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.865 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -164.54 133.56 3.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.852 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -43.51 -31.44 0.72 Allowed 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.613 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 6.8 mtt -77.76 -179.61 6.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.945 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 167.92 158.26 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.732 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.56 166.65 5.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.103 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 31.8 p -103.55 18.27 22.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.244 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 8.7 m95 -57.41 -31.99 66.41 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.865 0.364 . . . . 0.0 111.135 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.8 t -89.86 -42.2 11.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.872 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -68.43 -25.33 64.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.945 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.6 t 64.47 118.21 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.926 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -153.23 -157.57 8.12 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.456 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 31.1 t -128.15 94.07 2.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.809 0.338 . . . . 0.0 111.072 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.1 t -72.86 96.7 2.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.723 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.61 -162.21 0.86 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.666 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -77.72 137.1 38.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.762 0.315 . . . . 0.0 110.811 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -48.43 -28.4 3.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.143 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.5 t -96.89 29.89 2.89 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.802 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.407 ' HG3' ' N ' ' A' ' 24' ' ' CYS . 6.3 tp10 -57.9 118.76 5.69 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.735 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -83.28 7.48 16.29 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.786 -179.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -146.54 40.69 1.11 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.962 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.407 ' N ' ' HG3' ' A' ' 21' ' ' GLU . 0.1 OUTLIER -91.25 154.22 19.43 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.554 -178.955 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.8 mttt -107.85 158.79 32.57 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.774 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -67.78 90.86 0.36 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.546 2.164 . . . . 0.0 112.631 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.452 ' HB2' ' HA ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -70.3 168.8 15.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.286 179.757 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.483 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -118.15 106.12 12.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.138 179.451 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.503 ' CE2' HG22 ' A' ' 30' ' ' THR . 10.0 p-90 38.4 -160.11 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.907 -179.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.503 HG22 ' CE2' ' A' ' 29' ' ' TRP . 2.7 p 64.89 169.12 0.19 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.737 0.303 . . . . 0.0 110.555 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 38.1 p90 -141.81 174.66 10.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.026 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 35.4 t -89.9 -78.03 0.38 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.833 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 179.92 -54.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.707 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -89.9 139.66 30.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.786 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -67.96 -8.09 34.18 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.806 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 44.0 t-20 -89.98 -22.83 21.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.925 179.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 13.4 mp0 -127.69 147.23 50.38 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.775 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.14 149.06 50.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.177 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.5 t -80.06 127.4 32.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.681 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.452 ' HA ' ' HB2' ' A' ' 27' ' ' MET . 0.1 OUTLIER -112.27 169.55 8.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.192 -179.727 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -57.67 129.24 40.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.053 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 21.0 p90 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.208 -0.901 . . . . 0.0 112.073 -179.583 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.489 HG22 ' N ' ' A' ' 2' ' ' MET . 7.8 mt . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.863 0.363 . . . . 0.0 111.105 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.489 ' N ' HG22 ' A' ' 1' ' ' ILE . 0.0 OUTLIER -98.17 119.0 36.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.815 179.909 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 173.01 -34.77 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.918 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.419 ' CD2' ' O ' ' A' ' 4' ' ' PHE . 15.9 p90 -97.25 94.46 7.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.002 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -43.56 -69.58 0.13 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.478 -179.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 12.9 mtt -113.42 -178.15 3.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.898 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 168.88 -172.99 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.9 179.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.407 ' CB ' ' NE1' ' A' ' 10' ' ' TRP . . . -95.52 162.74 13.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.157 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.2 p -105.74 25.0 11.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.163 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.407 ' NE1' ' CB ' ' A' ' 8' ' ' ALA . 11.1 m95 -55.77 -39.2 70.89 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.879 0.371 . . . . 0.0 111.08 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.5 t -119.12 35.13 4.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.889 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -133.91 28.58 3.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.975 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.1 m 57.79 -175.48 0.07 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.997 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.01 163.45 24.86 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.462 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.413 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 3.1 t -118.2 96.91 4.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.907 0.385 . . . . 0.0 111.109 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 39.9 t -69.78 91.31 0.63 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.886 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.49 -167.04 1.33 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.507 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -111.13 74.75 0.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.868 0.366 . . . . 0.0 110.486 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.8 35.27 11.28 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.182 0.515 . . . . 0.0 109.97 -179.351 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.4 t -88.7 25.49 1.73 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.995 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -67.19 -1.95 5.1 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.625 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.97 10.45 11.78 Favored 'General case' 0 CA--C 1.528 0.101 0 CA-C-O 120.787 0.327 . . . . 0.0 111.637 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.13 -23.96 0.25 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.309 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.01 -178.02 4.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.807 0.337 . . . . 0.0 111.032 -179.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.1 mmmt -87.28 164.07 37.16 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.848 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -60.35 119.67 6.99 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.657 2.238 . . . . 0.0 112.454 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 6.8 ptt? -55.59 169.47 0.32 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.022 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -103.87 179.0 4.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.73 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.74 ' CE2' HG23 ' A' ' 30' ' ' THR . 45.9 p-90 -49.24 -44.67 43.77 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.315 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.74 HG23 ' CE2' ' A' ' 29' ' ' TRP . 74.5 p -58.88 156.43 11.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 9.7 p90 -133.14 -179.23 5.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.926 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.04 -71.73 0.67 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.995 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -178.49 -48.89 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.765 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 40.9 t-20 -89.9 139.55 30.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.918 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -66.13 -11.23 47.81 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.73 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -91.98 -24.03 19.36 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.043 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -97.72 135.69 39.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.833 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.64 143.37 47.73 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.041 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.3 t -91.31 89.02 7.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.967 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.413 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 2.8 t -50.44 153.86 1.45 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.04 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -102.68 95.2 6.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.828 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 6.2 p90 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.221 -0.895 . . . . 0.0 112.226 -179.564 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 8.5 pt . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.966 0.412 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.0 tmm? 61.73 80.76 0.21 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.938 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 60.6 111.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.853 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 12.8 p90 -110.04 135.88 50.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.884 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -43.73 -31.5 0.82 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.557 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 37.8 mmm -69.33 177.98 2.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.008 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.428 ' O ' HG22 ' A' ' 30' ' ' THR . 1.4 mt-30 169.33 -169.98 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.747 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.41 156.14 37.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.107 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 13.5 p -95.55 22.73 6.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.106 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 15.5 m0 -59.39 -25.46 64.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.302 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 33.4 t -89.96 -33.53 16.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.995 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -83.76 -25.12 30.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.051 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.4 m 65.82 122.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.945 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -154.22 -161.37 10.41 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.339 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.41 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 29.2 t -116.14 87.09 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.884 0.373 . . . . 0.0 111.103 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.6 t -57.22 91.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.108 -179.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.6 ttt85 -107.27 -158.64 0.66 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.565 179.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -93.02 146.79 23.37 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.825 0.345 . . . . 0.0 110.977 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.37 -26.81 8.41 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.03 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.442 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 33.3 t -97.95 32.72 2.3 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.459 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -61.45 117.07 5.22 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.178 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.442 ' HG3' ' O ' ' A' ' 20' ' ' SER . 0.0 OUTLIER -119.41 16.61 13.01 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.346 179.757 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -125.64 -26.51 3.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.662 0.268 . . . . 0.0 111.568 -179.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.71 -176.43 4.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.954 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.49 161.79 38.55 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.94 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -64.42 115.22 3.06 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.502 2.135 . . . . 0.0 112.18 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.79 156.22 11.57 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.067 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.473 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -127.89 105.26 8.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.511 179.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.514 ' CH2' HG23 ' A' ' 30' ' ' THR . 1.1 p-90 48.32 -179.74 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.344 -179.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.514 HG23 ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER 59.74 167.72 0.07 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.615 -179.308 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 5.6 p90 -144.09 178.31 7.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.146 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 38.6 t -89.89 -65.82 0.98 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.814 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -174.12 -55.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.713 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -91.44 149.87 21.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.694 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -68.6 -9.61 50.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.752 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -91.67 -18.89 23.3 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.223 179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -106.26 150.99 25.38 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.853 0.359 . . . . 0.0 111.012 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -131.77 137.3 48.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.901 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.3 t -76.63 92.19 3.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.07 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.41 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 0.0 OUTLIER -58.72 156.55 10.84 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.571 179.831 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -58.06 124.04 17.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.029 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 15.3 p90 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.228 -0.891 . . . . 0.0 112.106 -179.638 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.563 HD11 ' CZ ' ' A' ' 3' ' ' PHE . 16.9 pt . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.828 0.347 . . . . 0.0 111.165 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.3 mtt -89.85 -25.17 21.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.037 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.563 ' CZ ' HD11 ' A' ' 1' ' ' ILE . 1.9 m-85 63.63 149.44 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.917 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -98.6 31.43 2.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.96 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -43.55 -32.03 0.85 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.552 -179.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 49.7 mtp -129.22 -178.39 4.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.015 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 175.24 -167.61 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.661 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -112.23 176.23 5.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.215 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 2.5 p -114.43 28.81 8.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.075 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 8.3 m0 -52.67 -28.49 21.88 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.076 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 40.6 t -138.0 34.54 2.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.839 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -120.82 15.61 11.77 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.263 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 62.52 124.59 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.856 0.36 . . . . 0.0 111.058 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 162.11 164.83 17.9 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.474 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.456 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 1.5 t -112.96 106.04 19.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.854 0.359 . . . . 0.0 111.243 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 46.2 t -81.45 101.08 9.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.944 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.2 ttt85 -144.44 -161.59 1.31 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.756 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.419 ' CB ' ' HB3' ' A' ' 21' ' ' GLU . 1.5 m-20 -70.65 139.87 51.41 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.907 0.384 . . . . 0.0 110.87 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.472 ' CE ' ' HE2' ' A' ' 27' ' ' MET . 25.4 mtpt -79.33 -55.23 5.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.895 -179.368 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.7 t -82.3 7.97 12.5 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.936 -179.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.419 ' HB3' ' CB ' ' A' ' 18' ' ' ASP . 0.8 OUTLIER -107.67 -72.74 0.71 Allowed 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 120.722 0.296 . . . . 0.0 111.541 -179.575 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.22 156.75 33.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.046 0.451 . . . . 0.0 111.8 -179.341 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -115.82 56.49 0.77 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.155 179.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.72 -175.11 4.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.016 -179.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.56 167.75 5.15 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.595 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -76.24 105.74 2.13 Favored 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.415 2.077 . . . . 0.0 112.554 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.472 ' HE2' ' CE ' ' A' ' 19' ' ' LYS . 14.5 ptt? -45.75 167.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.056 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -117.1 -177.54 3.23 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.024 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 56.0 p-90 -43.2 -39.24 2.83 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.354 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 32.4 p -60.18 146.74 42.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.589 179.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -137.71 177.96 7.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.926 0.393 . . . . 0.0 111.233 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.19 -70.47 0.7 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.794 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -170.74 -39.16 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.626 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -108.38 144.52 35.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.528 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -69.13 -7.75 39.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.303 -0.408 . . . . 0.0 112.002 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -89.84 2.84 54.47 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.38 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -127.23 141.4 51.74 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.742 0.306 . . . . 0.0 110.894 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.454 ' HG2' ' HA ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -116.13 155.36 28.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.079 -179.843 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 11.9 t -104.28 85.0 2.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.389 179.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.456 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 5.0 t -42.81 136.27 2.68 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.215 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -86.65 112.73 21.9 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.897 179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.174 -0.917 . . . . 0.0 112.358 -179.535 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 1.9 pt . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.835 0.35 . . . . 0.0 111.133 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 41.6 ttp -79.7 -66.49 0.87 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.933 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -48.15 127.76 12.99 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.29 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -81.81 108.97 15.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.931 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -43.15 -74.54 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.601 -179.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 7.6 mtt -139.1 -173.71 3.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.894 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 173.38 169.83 0.16 Allowed 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.831 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.532 ' HB1' ' CE2' ' A' ' 10' ' ' TRP . . . -72.92 164.53 26.51 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.141 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 26.5 p -109.5 22.21 16.05 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.131 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.532 ' CE2' ' HB1' ' A' ' 8' ' ' ALA . 6.3 m95 -57.31 -51.23 70.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.963 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 21.7 t -89.93 7.89 35.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.333 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -111.54 -22.48 11.23 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.754 0.312 . . . . 0.0 111.161 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 66.65 146.37 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.952 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -179.91 -149.62 8.64 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.421 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.736 HG23 ' HA ' ' A' ' 42' ' ' TYR . 21.7 t -142.73 87.66 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.804 0.335 . . . . 0.0 111.0 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 48.0 t -66.42 94.35 0.27 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.652 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.04 -171.5 2.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.674 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.455 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 2.2 m-20 -72.81 135.45 45.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.848 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.402 ' HG2' ' HG2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -59.08 -37.27 76.71 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.953 179.994 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.1 t -101.95 33.12 3.15 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.893 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.455 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 0.9 OUTLIER -75.06 -174.51 2.29 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.095 179.768 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -123.38 17.4 9.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.507 -179.478 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.08 37.34 0.7 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.833 0.349 . . . . 0.0 110.819 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -95.47 133.18 39.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.087 -179.655 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.5 mmtp -93.32 158.64 36.74 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.854 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -48.04 90.89 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.681 2.254 . . . . 0.0 112.337 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.422 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 2.0 ppp? -54.67 165.4 0.6 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.432 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.465 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -134.81 93.45 3.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.652 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.526 ' CE2' HG22 ' A' ' 30' ' ' THR . 9.5 p-90 37.29 -158.96 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.889 -179.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.526 HG22 ' CE2' ' A' ' 29' ' ' TRP . 1.7 p 62.78 -177.02 0.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.793 0.33 . . . . 0.0 110.607 -179.104 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -152.65 160.62 43.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.916 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 41.0 t -89.99 -71.74 0.6 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.815 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -165.42 -68.98 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.899 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -90.04 153.61 20.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.82 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 mmp_? -68.41 -8.57 41.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.991 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -89.87 -20.92 22.84 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.053 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -122.81 128.55 50.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.809 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.402 ' HG2' ' HG2' ' A' ' 19' ' ' LYS . 0.1 OUTLIER -117.24 150.96 37.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.146 -179.82 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 5.2 t -80.85 83.33 6.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.552 179.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.422 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.2 OUTLIER -66.55 176.83 1.75 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.089 -179.696 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -63.72 118.87 8.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.015 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.736 ' HA ' HG23 ' A' ' 15' ' ' VAL . 2.8 p90 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.229 -0.891 . . . . 0.0 112.062 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 2.7 pt . . . . . 0 N--CA 1.485 1.304 0 CA-C-O 120.687 0.28 . . . . 0.0 111.07 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 37.72 -93.45 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.822 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -53.91 106.72 0.2 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.759 0.314 . . . . 0.0 111.143 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -176.9 153.77 1.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.928 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 177.97 61.44 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.703 179.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.6 mtp -141.27 -162.59 1.4 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.756 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 177.72 175.8 0.45 Allowed 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.938 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.56 ' HB3' ' CE3' ' A' ' 10' ' ' TRP . . . -81.77 172.58 13.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.267 -179.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.5 p -111.19 23.4 14.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.996 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.56 ' CE3' ' HB3' ' A' ' 8' ' ' ALA . 5.9 m0 -58.3 -19.9 38.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.411 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.8 t -89.71 -51.58 5.44 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.821 0.343 . . . . 0.0 111.227 -179.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -88.82 8.69 27.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.566 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 52.5 -168.04 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.819 0.342 . . . . 0.0 111.077 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 152.11 -166.4 31.0 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.531 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.413 HG23 ' HA ' ' A' ' 42' ' ' TYR . 21.4 t -119.7 92.63 2.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.814 0.34 . . . . 0.0 111.033 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 51.2 t -74.27 101.88 4.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.965 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.64 -163.89 1.44 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.763 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -78.0 136.92 38.04 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.865 0.364 . . . . 0.0 110.955 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.7 mttt -58.48 -27.08 64.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.978 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.6 t -107.09 35.6 2.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.738 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -74.61 168.79 19.09 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 121.132 0.491 . . . . 0.0 110.407 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.08 16.14 16.04 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.492 -179.547 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -150.2 31.51 0.68 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.882 0.372 . . . . 0.0 110.648 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.7 146.65 23.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.115 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.422 ' CB ' ' HD2' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -95.96 167.21 12.91 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.81 179.962 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.422 ' HD2' ' CB ' ' A' ' 25' ' ' LYS . 9.5 Cg_endo -50.8 87.82 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.66 2.24 . . . . 0.0 112.417 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.405 ' N ' ' O ' ' A' ' 25' ' ' LYS . 5.4 ppp? -60.48 166.43 3.13 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.207 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -123.3 177.08 5.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.948 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 63.4 p-90 -48.08 -28.85 3.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.248 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 26.6 p -67.88 148.94 50.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.857 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 41.5 p90 -136.21 -177.53 4.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.907 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.81 -70.87 0.64 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.908 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 179.16 -44.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.766 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -90.06 144.04 26.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.863 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -67.21 -10.92 55.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.839 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -89.97 -21.97 22.16 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.139 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 71.2 mm-40 -123.72 143.14 50.46 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.942 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -130.31 160.79 32.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.001 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.8 t -93.37 106.07 18.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.711 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 m -86.2 175.08 8.69 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.958 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.416 ' HB3' ' HB3' ' A' ' 25' ' ' LYS . 2.0 tp10 -63.56 115.87 5.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.947 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.413 ' HA ' HG23 ' A' ' 15' ' ' VAL . 38.3 p90 . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.214 -0.898 . . . . 0.0 112.144 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.564 ' O ' HG23 ' A' ' 1' ' ' ILE . 1.2 tt . . . . . 0 N--CA 1.485 1.306 0 CA-C-O 121.004 0.431 . . . . 0.0 111.039 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 64.63 15.26 9.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.402 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 20.3 p90 172.49 157.97 0.1 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.799 0.333 . . . . 0.0 110.825 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.406 ' O ' ' HB2' ' A' ' 5' ' ' GLU . 27.5 m-85 -127.18 -175.39 3.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.878 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' A' ' 4' ' ' PHE . 0.4 OUTLIER 179.47 -38.89 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.864 179.647 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.3 mtt -59.35 -162.76 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.745 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 175.11 151.64 0.11 Allowed 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 120.828 0.346 . . . . 0.0 110.904 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.93 165.95 8.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.194 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 11.8 p -102.32 28.02 6.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.889 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 18.7 m0 -56.03 -28.78 58.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.203 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.2 t -89.97 -64.4 1.14 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.018 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 64.9 t-80 -57.07 -28.67 62.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.038 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.8 p 62.78 121.54 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.012 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -135.48 -133.27 3.23 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.467 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.419 HG12 ' HD3' ' A' ' 17' ' ' ARG . 21.5 t -144.22 85.52 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.758 0.314 . . . . 0.0 111.236 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.1 t -70.07 96.56 1.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.736 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.419 ' HD3' HG12 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -126.54 -162.92 1.18 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.745 -179.953 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 1.1 m-20 -77.37 132.79 38.73 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.95 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.6 mttt -50.8 -29.54 11.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.972 0.415 . . . . 0.0 110.876 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 11.0 t -104.22 32.39 4.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.979 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 10.9 tp10 -67.68 140.42 56.8 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.338 0.59 . . . . 0.0 110.295 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.85 14.61 15.02 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.621 -179.294 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -150.35 34.47 0.64 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.822 0.344 . . . . 0.0 110.8 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -94.1 162.62 13.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.321 -179.498 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.44 ' CD ' ' HD2' ' A' ' 26' ' ' PRO . 22.5 mmtm -115.94 164.25 18.36 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.621 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.44 ' HD2' ' CD ' ' A' ' 25' ' ' LYS . 9.1 Cg_endo -50.69 90.25 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.571 2.181 . . . . 0.0 112.572 -179.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.41 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 0.7 OUTLIER -57.0 164.98 1.38 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.19 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -117.69 178.03 4.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.058 179.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.5 ' CH2' HG22 ' A' ' 30' ' ' THR . 38.5 p-90 -48.07 -29.75 3.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.344 -179.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.5 HG22 ' CH2' ' A' ' 29' ' ' TRP . 29.1 p -58.3 150.41 22.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.034 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.0 p90 -127.18 176.69 7.19 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.916 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 25.7 t -103.31 -67.07 0.9 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.895 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.1 tp10 -178.77 -63.99 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.733 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 20.4 t30 -89.96 149.82 22.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.796 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.1 mmp_? -67.69 -8.45 35.21 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.079 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 36.4 t-20 -89.66 -23.11 21.97 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.805 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -120.04 130.5 54.74 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.487 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.91 145.57 47.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.307 -179.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.9 t -83.31 97.26 8.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.644 179.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.41 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.8 OUTLIER -71.55 170.44 13.36 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.934 -179.697 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.425 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 2.6 tt0 -93.72 116.9 29.41 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.188 -179.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.409 ' C ' ' O ' ' A' ' 41' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.261 -0.876 . . . . 0.0 112.449 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 26.4 mm . . . . . 0 N--CA 1.485 1.3 0 CA-C-O 120.785 0.326 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.8 mtt -114.4 101.47 9.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.883 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 172.41 -40.89 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.798 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 4.0 t80 60.22 110.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.829 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 178.11 -39.04 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.933 179.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 7.0 mtt -106.18 178.83 4.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.981 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 168.01 -171.34 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.79 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.43 ' HB2' ' CE1' ' A' ' 31' ' ' TYR . . . -85.17 174.24 9.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.986 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 12.1 m -97.19 21.71 9.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.12 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 9.1 m0 -56.85 -32.77 66.12 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.821 0.344 . . . . 0.0 111.016 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.3 t -97.69 -43.78 7.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.981 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.894 ' CD2' HG21 ' A' ' 30' ' ' THR . 37.2 m-70 -58.1 -31.6 67.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.947 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t 62.33 31.34 17.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.086 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -58.96 -164.27 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.217 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.493 ' HB ' ' HB3' ' A' ' 40' ' ' CYS . 1.1 t -116.74 94.44 3.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.938 0.399 . . . . 0.0 110.994 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 41.3 t -67.34 106.7 2.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.984 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.7 -158.65 0.65 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.657 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.27 142.41 27.44 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.838 0.351 . . . . 0.0 110.803 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.06 -37.54 69.42 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.889 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 10.6 t -74.94 -11.47 60.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.131 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -98.81 92.48 5.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.807 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.42 ' CD ' ' N ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -97.06 40.63 1.14 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.893 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.12 -26.84 20.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.968 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.98 177.87 6.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.789 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.53 144.12 92.76 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.747 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -88.18 95.41 0.4 Allowed 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 122.937 2.424 . . . . 0.0 112.8 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.451 ' HG2' ' NE1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -76.22 100.92 5.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.644 179.628 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -102.46 55.64 0.78 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.011 0.434 . . . . 0.0 111.657 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.851 ' CE3' HG23 ' A' ' 30' ' ' THR . 5.1 p-90 -168.1 -43.6 0.02 OUTLIER 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.481 179.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.894 HG21 ' CD2' ' A' ' 12' ' ' HIS . 7.7 p -101.33 168.87 9.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.703 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.43 ' CE1' ' HB2' ' A' ' 8' ' ' ALA . 23.2 p90 -140.09 166.06 25.67 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.191 -179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 35.7 t -89.92 -75.08 0.46 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.937 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -176.0 -46.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.786 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 33.0 t-20 -101.91 145.64 28.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.749 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -69.49 -8.67 48.97 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.868 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 -89.99 -17.22 28.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.145 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 9.2 mp0 -106.59 166.34 10.63 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.905 0.383 . . . . 0.0 110.872 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.02 113.97 8.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.732 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 9.1 t -59.34 136.89 58.11 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.943 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.493 ' HB3' ' HB ' ' A' ' 15' ' ' VAL . 13.3 t -97.97 136.23 38.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.677 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.82 89.69 4.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.938 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 30.0 p90 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.238 -0.887 . . . . 0.0 112.114 -179.603 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.603 ' O ' HG23 ' A' ' 1' ' ' ILE . 4.1 tt . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 120.919 0.39 . . . . 0.0 111.02 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 37.8 mtt -105.84 109.04 20.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.914 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -47.97 105.92 0.08 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.156 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -72.41 167.66 20.07 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.075 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 178.45 39.46 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.576 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 2.8 mmm -105.01 -152.26 0.46 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.722 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -175.71 146.19 0.74 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 120.819 0.343 . . . . 0.0 110.825 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.728 ' HB3' ' CD1' ' A' ' 10' ' ' TRP . . . -55.09 177.26 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.244 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.02 8.89 27.34 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.215 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.728 ' CD1' ' HB3' ' A' ' 8' ' ' ALA . 8.0 m95 -54.57 -29.84 52.49 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.816 0.341 . . . . 0.0 111.091 -179.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.6 t -108.65 40.07 1.87 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.918 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -164.26 -51.25 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.863 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 61.64 100.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.897 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -119.6 -117.09 2.62 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.478 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.593 HG23 ' HA ' ' A' ' 42' ' ' TYR . 21.7 t -132.45 80.42 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.855 0.36 . . . . 0.0 111.15 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.3 t -72.49 89.54 1.27 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.639 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -140.49 -166.58 2.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.768 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.456 ' O ' ' HB2' ' A' ' 21' ' ' GLU . 11.8 t70 -66.17 136.11 55.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.864 0.364 . . . . 0.0 110.695 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.8 mtmm -60.69 -29.54 69.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.736 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.6 t -107.66 35.77 2.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.605 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.456 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 0.5 OUTLIER -75.46 -164.5 0.34 Allowed 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.4 -179.982 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -118.99 18.16 13.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.695 0.283 . . . . 0.0 111.201 -179.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -148.18 35.7 0.82 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.876 0.37 . . . . 0.0 110.69 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -97.29 126.94 42.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.999 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.3 mtpp -113.08 163.56 17.76 Favored Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.964 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.74 91.67 0.09 OUTLIER 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.55 2.167 . . . . 0.0 112.58 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . 0.465 ' HB3' ' HA ' ' A' ' 40' ' ' CYS . 0.0 OUTLIER -77.97 171.72 14.57 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.175 0.512 . . . . 0.0 111.286 179.812 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.482 ' O ' ' CD1' ' A' ' 29' ' ' TRP . . . -122.76 108.9 13.56 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.437 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.505 ' CE2' HG22 ' A' ' 30' ' ' THR . 9.3 p-90 37.49 -159.32 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.946 -0.57 . . . . 0.0 112.098 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.505 HG22 ' CE2' ' A' ' 29' ' ' TRP . 3.0 p 65.4 157.37 0.1 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.737 0.303 . . . . 0.0 110.592 -179.216 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 31.4 p90 -136.72 175.38 9.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.092 -179.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.7 t -98.38 -73.58 0.61 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.987 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -179.59 -51.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.868 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -90.0 136.7 32.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.881 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -69.74 -6.73 33.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.807 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -89.96 -19.21 24.76 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.879 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -131.22 141.53 50.05 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.892 0.377 . . . . 0.0 110.801 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.36 158.59 23.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.835 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 9.8 t -89.99 80.76 6.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.815 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.465 ' HA ' ' HB3' ' A' ' 27' ' ' MET . 0.0 OUTLIER -65.3 171.23 3.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.779 179.955 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.41 ' N ' ' HB3' ' A' ' 27' ' ' MET . 7.7 tp10 -63.86 120.72 12.45 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.061 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.593 ' HA ' HG23 ' A' ' 15' ' ' VAL . 2.9 p90 . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.235 -0.888 . . . . 0.0 112.045 -179.721 . . . . . . . . 1 1 . 1 stop_ save_